BindingDB Reactant_set_id Ligand SMILES Ligand InChI Ligand InChI Key BindingDB MonomerID BindingDB Ligand Name Target Name Target Source Organism According to Curator or DataSource Ki (nM) IC50 (nM) Kd (nM) EC50 (nM) kon (M-1-s-1) koff (s-1) pH Temp (C) Curation/DataSource Article DOI BindingDB Entry DOI PMID PubChem AID Patent Number Authors Institution Link to Ligand in BindingDB Link to Target in BindingDB Link to Ligand-Target Pair in BindingDB Ligand HET ID in PDB PDB ID(s) for Ligand-Target Complex PubChem CID of Ligand PubChem SID of Ligand ChEBI ID of Ligand ChEMBL ID of Ligand DrugBank ID of Ligand IUPHAR_GRAC ID of Ligand KEGG ID of Ligand ZINC ID of Ligand Number of Protein Chains in Target (>1 implies a multichain complex) BindingDB Target Chain Sequence PDB ID(s) of Target Chain UniProt (SwissProt) Recommended Name of Target Chain UniProt (SwissProt) Entry Name of Target Chain UniProt (SwissProt) Primary ID of Target Chain UniProt (SwissProt) Secondary ID(s) of Target Chain UniProt (SwissProt) Alternative ID(s) of Target Chain UniProt (TrEMBL) Submitted Name of Target Chain UniProt (TrEMBL) Entry Name of Target Chain UniProt (TrEMBL) Primary ID of Target Chain UniProt (TrEMBL) Secondary ID(s) of Target Chain UniProt (TrEMBL) Alternative ID(s) of Target Chain 50613075 NC1=NS(=O)(=O)NC(=N)C1=Cc1ccc(o1)[N+]([O-])=O InChI=1S/C8H7N5O5S/c9-7-5(8(10)12-19(16,17)11-7)3-4-1-2-6(18-4)13(14)15/h1-3H,(H2,9,11)(H2,10,12) XEORIUZUCHZWMP-UHFFFAOYSA-N 50332792 4-(5-Nitro-furan-2-ylmethylene)-1,1-dioxo-1,4-dihydro-1lambda*6*-[1,2, 6]thiadiazine-3,5-diamine::CHEMBL1630893 Triosephosphate isomerase, glycosomal Trypanosoma cruzi 20000 ChEMBL 10.1016/j.ejmech.2010.09.034 10.7270/Q2QN6719 20889239 Alvarez, G; Aguirre-Lopez, B; Varela, J; Cabrera, M; Merlino, A; Lopez, GV; Lavaggi, ML; Porcal, W; Di Maio, R; Gonzalez, M; Cerecetto, H; Cabrera, N; Perez-Montfort, R; de Gomez-Puyou, MT; Gomez-Puyou, A Universidad de la Rep£blica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50332792 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004647&target=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50332792&enzyme=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search 373938 125082894 CHEMBL1630893 ZINC16958220 1 MASKPQPIAAANWKCNGSESLLVPLIETLNAATFDHDVQCVVAPTFLHIPMTKARLTNPKFQIAAQNAITRSGAFTGEVSLQILKDYGISWVVLGHSERRLYYGETNEIVAEKVAQACAAGFHVIVCVGETNEEREAGRTAAVVLTQLAAVAQKLSKEAWSRVVIAYEPVWAIGTGKVATPQQAQEVHELLRRWVRSKLGTDIAAQLRILYGGSVTAKNARTLYQMRDINGFLVGGASLKPEFVEIIEATK 1CI1,1SUX,1TCD,2OMA Triosephosphate isomerase, glycosomal TPIS_TRYCR P52270 50613076 [O-][N+](=O)c1ccc(C=C2C(=O)N(Cc3ccccc3)S(=O)(=O)N(Cc3ccccc3)C2=O)o1 InChI=1S/C22H17N3O7S/c26-21-19(13-18-11-12-20(32-18)25(28)29)22(27)24(15-17-9-5-2-6-10-17)33(30,31)23(21)14-16-7-3-1-4-8-16/h1-13H,14-15H2 IAFAANQPDPWPHK-UHFFFAOYSA-N 50332793 2,6-Dibenzyl-4-(5-nitro-furan-2-ylm ethylene)-1,1-dioxo-1lambda*6*-[1,2 ,6]thiadiazinane-3,5-dione::CHEMBL1630897 Triosephosphate isomerase, glycosomal Trypanosoma cruzi 13000 ChEMBL 10.1016/j.ejmech.2010.09.034 10.7270/Q2QN6719 20889239 Alvarez, G; Aguirre-Lopez, B; Varela, J; Cabrera, M; Merlino, A; Lopez, GV; Lavaggi, ML; Porcal, W; Di Maio, R; Gonzalez, M; Cerecetto, H; Cabrera, N; Perez-Montfort, R; de Gomez-Puyou, MT; Gomez-Puyou, A Universidad de la Rep£blica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50332793 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004647&target=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50332793&enzyme=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search 10766661 125082895 CHEMBL1630897 ZINC66260042 1 MASKPQPIAAANWKCNGSESLLVPLIETLNAATFDHDVQCVVAPTFLHIPMTKARLTNPKFQIAAQNAITRSGAFTGEVSLQILKDYGISWVVLGHSERRLYYGETNEIVAEKVAQACAAGFHVIVCVGETNEEREAGRTAAVVLTQLAAVAQKLSKEAWSRVVIAYEPVWAIGTGKVATPQQAQEVHELLRRWVRSKLGTDIAAQLRILYGGSVTAKNARTLYQMRDINGFLVGGASLKPEFVEIIEATK 1CI1,1SUX,1TCD,2OMA Triosephosphate isomerase, glycosomal TPIS_TRYCR P52270 50613077 Oc1ccc2[n+]([O-])c3cc(Cl)c(Cl)cc3[n+]([O-])c2c1 InChI=1S/C12H6Cl2N2O3/c13-7-4-11-12(5-8(7)14)16(19)10-3-6(17)1-2-9(10)15(11)18/h1-5,17H SPDZOGVSSSQFAS-UHFFFAOYSA-N 50332794 2,3-dichloro-7-hydroxyphenazine5,10-dioxide::7,8-Dichloro-2-hydroxyphenazine5,10-dioxide::CHEMBL1288605 Triosephosphate isomerase, glycosomal Trypanosoma cruzi 26000 ChEMBL 10.1016/j.ejmech.2010.09.034 10.7270/Q2QN6719 20889239 Alvarez, G; Aguirre-Lopez, B; Varela, J; Cabrera, M; Merlino, A; Lopez, GV; Lavaggi, ML; Porcal, W; Di Maio, R; Gonzalez, M; Cerecetto, H; Cabrera, N; Perez-Montfort, R; de Gomez-Puyou, MT; Gomez-Puyou, A Universidad de la Rep£blica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50332794 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004647&target=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50332794&enzyme=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search 49845058 125082896 CHEMBL1288605 ZINC64550085 1 MASKPQPIAAANWKCNGSESLLVPLIETLNAATFDHDVQCVVAPTFLHIPMTKARLTNPKFQIAAQNAITRSGAFTGEVSLQILKDYGISWVVLGHSERRLYYGETNEIVAEKVAQACAAGFHVIVCVGETNEEREAGRTAAVVLTQLAAVAQKLSKEAWSRVVIAYEPVWAIGTGKVATPQQAQEVHELLRRWVRSKLGTDIAAQLRILYGGSVTAKNARTLYQMRDINGFLVGGASLKPEFVEIIEATK 1CI1,1SUX,1TCD,2OMA Triosephosphate isomerase, glycosomal TPIS_TRYCR P52270 50613078 Cc1ccc(cc1)-c1nc(=O)s[nH]1 InChI=1S/C9H8N2OS/c1-6-2-4-7(5-3-6)8-10-9(12)13-11-8/h2-5H,1H3,(H,10,11,12) XXKKENPLAPXKFL-UHFFFAOYSA-N 50332795 3-(4-methylphenyl)-5-oxo-4,5-dihydro-1,2,4-thiadiazole::3-p-tolyl-1,2,4-thiadiazol-5(4H)-one::CHEMBL258634 Triosephosphate isomerase, glycosomal Trypanosoma cruzi 3500 ChEMBL 10.1016/j.ejmech.2010.09.034 10.7270/Q2QN6719 20889239 Alvarez, G; Aguirre-Lopez, B; Varela, J; Cabrera, M; Merlino, A; Lopez, GV; Lavaggi, ML; Porcal, W; Di Maio, R; Gonzalez, M; Cerecetto, H; Cabrera, N; Perez-Montfort, R; de Gomez-Puyou, MT; Gomez-Puyou, A Universidad de la Rep£blica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50332795 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004647&target=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50332795&enzyme=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search 13814047 125082897 CHEMBL258634 ZINC29124102 1 MASKPQPIAAANWKCNGSESLLVPLIETLNAATFDHDVQCVVAPTFLHIPMTKARLTNPKFQIAAQNAITRSGAFTGEVSLQILKDYGISWVVLGHSERRLYYGETNEIVAEKVAQACAAGFHVIVCVGETNEEREAGRTAAVVLTQLAAVAQKLSKEAWSRVVIAYEPVWAIGTGKVATPQQAQEVHELLRRWVRSKLGTDIAAQLRILYGGSVTAKNARTLYQMRDINGFLVGGASLKPEFVEIIEATK 1CI1,1SUX,1TCD,2OMA Triosephosphate isomerase, glycosomal TPIS_TRYCR P52270 50613079 O=c1oc(ns1)-c1ccccc1 InChI=1S/C8H5NO2S/c10-8-11-7(9-12-8)6-4-2-1-3-5-6/h1-5H NDAURKDIFHXVHE-UHFFFAOYSA-N 50332796 5-phenyl-1,3,4-oxathiazol-2-one::CHEMBL1632533 Triosephosphate isomerase, glycosomal Trypanosoma cruzi 10000 ChEMBL 10.1016/j.ejmech.2010.09.034 10.7270/Q2QN6719 20889239 Alvarez, G; Aguirre-Lopez, B; Varela, J; Cabrera, M; Merlino, A; Lopez, GV; Lavaggi, ML; Porcal, W; Di Maio, R; Gonzalez, M; Cerecetto, H; Cabrera, N; Perez-Montfort, R; de Gomez-Puyou, MT; Gomez-Puyou, A Universidad de la Rep£blica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50332796 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004647&target=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50332796&enzyme=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search 853170 125082898 CHEMBL1632533 ZINC00389752 1 MASKPQPIAAANWKCNGSESLLVPLIETLNAATFDHDVQCVVAPTFLHIPMTKARLTNPKFQIAAQNAITRSGAFTGEVSLQILKDYGISWVVLGHSERRLYYGETNEIVAEKVAQACAAGFHVIVCVGETNEEREAGRTAAVVLTQLAAVAQKLSKEAWSRVVIAYEPVWAIGTGKVATPQQAQEVHELLRRWVRSKLGTDIAAQLRILYGGSVTAKNARTLYQMRDINGFLVGGASLKPEFVEIIEATK 1CI1,1SUX,1TCD,2OMA Triosephosphate isomerase, glycosomal TPIS_TRYCR P52270 51321259 COC(=O)c1cc2nc(SCC(=O)Nc3ncc(s3)[N+]([O-])=O)[nH]c2cc1Cl InChI=1S/C14H10ClN5O5S2/c1-25-12(22)6-2-8-9(3-7(6)15)18-14(17-8)26-5-10(21)19-13-16-4-11(27-13)20(23)24/h2-4H,5H2,1H3,(H,17,18)(H,16,19,21) BPZPPMXJWIPQSY-UHFFFAOYSA-N 50534545 CHEMBL4576576 Triosephosphate isomerase, glycosomal Trypanosoma cruzi 77000 ChEMBL 10.1016/j.bmcl.2015.08.018 10.7270/Q2R78JQX 27503677 Velázquez-López, JM; Hernández-Campos, A; Yépez-Mulia, L; Téllez-Valencia, A; Flores-Carrillo, P; Nieto-Meneses, R; Castillo, R Universidad Nacional Aut£noma de M£xico http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50534545 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004647&target=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50534545&enzyme=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search 155553740 440743127 1 MASKPQPIAAANWKCNGSESLLVPLIETLNAATFDHDVQCVVAPTFLHIPMTKARLTNPKFQIAAQNAITRSGAFTGEVSLQILKDYGISWVVLGHSERRLYYGETNEIVAEKVAQACAAGFHVIVCVGETNEEREAGRTAAVVLTQLAAVAQKLSKEAWSRVVIAYEPVWAIGTGKVATPQQAQEVHELLRRWVRSKLGTDIAAQLRILYGGSVTAKNARTLYQMRDINGFLVGGASLKPEFVEIIEATK 1CI1,1SUX,1TCD,2OMA Triosephosphate isomerase, glycosomal TPIS_TRYCR P52270 51321260 COC(=O)c1cc2nc(SCC(=O)Nc3cnccn3)[nH]c2cc1Cl InChI=1S/C15H12ClN5O3S/c1-24-14(23)8-4-10-11(5-9(8)16)20-15(19-10)25-7-13(22)21-12-6-17-2-3-18-12/h2-6H,7H2,1H3,(H,19,20)(H,18,21,22) GSTNPNQEANEZKC-UHFFFAOYSA-N 50534546 CHEMBL4462472 Triosephosphate isomerase, glycosomal Trypanosoma cruzi 82000 ChEMBL 10.1016/j.bmcl.2015.08.018 10.7270/Q2R78JQX 27503677 Velázquez-López, JM; Hernández-Campos, A; Yépez-Mulia, L; Téllez-Valencia, A; Flores-Carrillo, P; Nieto-Meneses, R; Castillo, R Universidad Nacional Aut£noma de M£xico http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50534546 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004647&target=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50534546&enzyme=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search 155529338 440743128 1 MASKPQPIAAANWKCNGSESLLVPLIETLNAATFDHDVQCVVAPTFLHIPMTKARLTNPKFQIAAQNAITRSGAFTGEVSLQILKDYGISWVVLGHSERRLYYGETNEIVAEKVAQACAAGFHVIVCVGETNEEREAGRTAAVVLTQLAAVAQKLSKEAWSRVVIAYEPVWAIGTGKVATPQQAQEVHELLRRWVRSKLGTDIAAQLRILYGGSVTAKNARTLYQMRDINGFLVGGASLKPEFVEIIEATK 1CI1,1SUX,1TCD,2OMA Triosephosphate isomerase, glycosomal TPIS_TRYCR P52270 51321261 COC(=O)c1cc2nc(SCC(=O)Nc3nccs3)[nH]c2cc1Cl InChI=1S/C14H11ClN4O3S2/c1-22-12(21)7-4-9-10(5-8(7)15)18-14(17-9)24-6-11(20)19-13-16-2-3-23-13/h2-5H,6H2,1H3,(H,17,18)(H,16,19,20) IWJYZFJSMPUOPG-UHFFFAOYSA-N 50534547 CHEMBL4443832 Triosephosphate isomerase, glycosomal Trypanosoma cruzi 223000 ChEMBL 10.1016/j.bmcl.2015.08.018 10.7270/Q2R78JQX 27503677 Velázquez-López, JM; Hernández-Campos, A; Yépez-Mulia, L; Téllez-Valencia, A; Flores-Carrillo, P; Nieto-Meneses, R; Castillo, R Universidad Nacional Aut£noma de M£xico http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50534547 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004647&target=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50534547&enzyme=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search 155516816 440743129 1 MASKPQPIAAANWKCNGSESLLVPLIETLNAATFDHDVQCVVAPTFLHIPMTKARLTNPKFQIAAQNAITRSGAFTGEVSLQILKDYGISWVVLGHSERRLYYGETNEIVAEKVAQACAAGFHVIVCVGETNEEREAGRTAAVVLTQLAAVAQKLSKEAWSRVVIAYEPVWAIGTGKVATPQQAQEVHELLRRWVRSKLGTDIAAQLRILYGGSVTAKNARTLYQMRDINGFLVGGASLKPEFVEIIEATK 1CI1,1SUX,1TCD,2OMA Triosephosphate isomerase, glycosomal TPIS_TRYCR P52270 51484008 Cc1ccc(cc1)-c1nc(=O)s[nH]1 InChI=1S/C9H8N2OS/c1-6-2-4-7(5-3-6)8-10-9(12)13-11-8/h2-5H,1H3,(H,10,11,12) XXKKENPLAPXKFL-UHFFFAOYSA-N 50332795 3-(4-methylphenyl)-5-oxo-4,5-dihydro-1,2,4-thiadiazole::3-p-tolyl-1,2,4-thiadiazol-5(4H)-one::CHEMBL258634 Triosephosphate isomerase, glycosomal Trypanosoma cruzi 3500 ChEMBL 10.7270/Q2J67MZ9 35189560 Beltran-Hortelano, I; Alcolea, V; Font, M; Pérez-Silanes, S Universidad de Navarra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50332795 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004647&target=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50332795&enzyme=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search 13814047 125082897 CHEMBL258634 ZINC29124102 1 MASKPQPIAAANWKCNGSESLLVPLIETLNAATFDHDVQCVVAPTFLHIPMTKARLTNPKFQIAAQNAITRSGAFTGEVSLQILKDYGISWVVLGHSERRLYYGETNEIVAEKVAQACAAGFHVIVCVGETNEEREAGRTAAVVLTQLAAVAQKLSKEAWSRVVIAYEPVWAIGTGKVATPQQAQEVHELLRRWVRSKLGTDIAAQLRILYGGSVTAKNARTLYQMRDINGFLVGGASLKPEFVEIIEATK 1CI1,1SUX,1TCD,2OMA Triosephosphate isomerase, glycosomal TPIS_TRYCR P52270 51484009 O=C(\C=C\C=C\c1ccco1)/C=C/C=C/c1ccco1 InChI=1S/C17H14O3/c18-15(7-1-3-9-16-11-5-13-19-16)8-2-4-10-17-12-6-14-20-17/h1-14H/b7-1+,8-2+,9-3+,10-4+ JHGFEQGWJVCBOX-BWZMWZRISA-N 50597987 CHEMBL5170853 Triosephosphate isomerase, glycosomal Trypanosoma cruzi 3000 ChEMBL 10.7270/Q2J67MZ9 35189560 Beltran-Hortelano, I; Alcolea, V; Font, M; Pérez-Silanes, S Universidad de Navarra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50597987 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004647&target=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50597987&enzyme=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search 21443779 482608839 1 MASKPQPIAAANWKCNGSESLLVPLIETLNAATFDHDVQCVVAPTFLHIPMTKARLTNPKFQIAAQNAITRSGAFTGEVSLQILKDYGISWVVLGHSERRLYYGETNEIVAEKVAQACAAGFHVIVCVGETNEEREAGRTAAVVLTQLAAVAQKLSKEAWSRVVIAYEPVWAIGTGKVATPQQAQEVHELLRRWVRSKLGTDIAAQLRILYGGSVTAKNARTLYQMRDINGFLVGGASLKPEFVEIIEATK 1CI1,1SUX,1TCD,2OMA Triosephosphate isomerase, glycosomal TPIS_TRYCR P52270 51484010 [O-][N+](=O)c1cnc(NC(=O)CSc2nc3ccccc3[nH]2)s1 InChI=1S/C12H9N5O3S2/c18-9(16-11-13-5-10(22-11)17(19)20)6-21-12-14-7-3-1-2-4-8(7)15-12/h1-5H,6H2,(H,14,15)(H,13,16,18) IRHPCJOGNMKBHW-UHFFFAOYSA-N 50597988 CHEMBL5192352 Triosephosphate isomerase, glycosomal Trypanosoma cruzi 3000 ChEMBL 10.7270/Q2J67MZ9 35189560 Beltran-Hortelano, I; Alcolea, V; Font, M; Pérez-Silanes, S Universidad de Navarra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50597988 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004647&target=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50597988&enzyme=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search 3129892 482608840 1 MASKPQPIAAANWKCNGSESLLVPLIETLNAATFDHDVQCVVAPTFLHIPMTKARLTNPKFQIAAQNAITRSGAFTGEVSLQILKDYGISWVVLGHSERRLYYGETNEIVAEKVAQACAAGFHVIVCVGETNEEREAGRTAAVVLTQLAAVAQKLSKEAWSRVVIAYEPVWAIGTGKVATPQQAQEVHELLRRWVRSKLGTDIAAQLRILYGGSVTAKNARTLYQMRDINGFLVGGASLKPEFVEIIEATK 1CI1,1SUX,1TCD,2OMA Triosephosphate isomerase, glycosomal TPIS_TRYCR P52270 51484011 OS(=O)(=O)CCCSc1nc2ccccc2s1 InChI=1S/C10H11NO3S3/c12-17(13,14)7-3-6-15-10-11-8-4-1-2-5-9(8)16-10/h1-2,4-5H,3,6-7H2,(H,12,13,14) XBNHRNFODJOFRU-UHFFFAOYSA-N 50597989 CHEMBL1161789 Triosephosphate isomerase, glycosomal Trypanosoma cruzi 33000 ChEMBL 10.7270/Q2J67MZ9 35189560 Beltran-Hortelano, I; Alcolea, V; Font, M; Pérez-Silanes, S Universidad de Navarra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50597989 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004647&target=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50597989&enzyme=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search BTS 162569 482608841 1 MASKPQPIAAANWKCNGSESLLVPLIETLNAATFDHDVQCVVAPTFLHIPMTKARLTNPKFQIAAQNAITRSGAFTGEVSLQILKDYGISWVVLGHSERRLYYGETNEIVAEKVAQACAAGFHVIVCVGETNEEREAGRTAAVVLTQLAAVAQKLSKEAWSRVVIAYEPVWAIGTGKVATPQQAQEVHELLRRWVRSKLGTDIAAQLRILYGGSVTAKNARTLYQMRDINGFLVGGASLKPEFVEIIEATK 1CI1,1SUX,1TCD,2OMA Triosephosphate isomerase, glycosomal TPIS_TRYCR P52270 51484012 Cc1ccc2nc(sc2c1S(O)(=O)=O)-c1ccc2nc(sc2c1)-c1ccc(N)cc1 InChI=1S/C21H15N3O3S3/c1-11-2-8-16-18(19(11)30(25,26)27)29-21(24-16)13-5-9-15-17(10-13)28-20(23-15)12-3-6-14(22)7-4-12/h2-10H,22H2,1H3,(H,25,26,27) CTPFWVHDVOKBSN-UHFFFAOYSA-N 50597990 CHEMBL3990589 Triosephosphate isomerase, glycosomal Trypanosoma cruzi 8000 ChEMBL 10.7270/Q2J67MZ9 35189560 Beltran-Hortelano, I; Alcolea, V; Font, M; Pérez-Silanes, S Universidad de Navarra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50597990 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004647&target=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50597990&enzyme=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search 79954 482608842 1 MASKPQPIAAANWKCNGSESLLVPLIETLNAATFDHDVQCVVAPTFLHIPMTKARLTNPKFQIAAQNAITRSGAFTGEVSLQILKDYGISWVVLGHSERRLYYGETNEIVAEKVAQACAAGFHVIVCVGETNEEREAGRTAAVVLTQLAAVAQKLSKEAWSRVVIAYEPVWAIGTGKVATPQQAQEVHELLRRWVRSKLGTDIAAQLRILYGGSVTAKNARTLYQMRDINGFLVGGASLKPEFVEIIEATK 1CI1,1SUX,1TCD,2OMA Triosephosphate isomerase, glycosomal TPIS_TRYCR P52270 51484013 [O-][N+](=O)c1ccc(C=C2C(=O)N(Cc3ccccc3)S(=O)(=O)N(Cc3ccccc3)C2=O)o1 InChI=1S/C22H17N3O7S/c26-21-19(13-18-11-12-20(32-18)25(28)29)22(27)24(15-17-9-5-2-6-10-17)33(30,31)23(21)14-16-7-3-1-4-8-16/h1-13H,14-15H2 IAFAANQPDPWPHK-UHFFFAOYSA-N 50597991 CHEMBL5198783 Triosephosphate isomerase, glycosomal Trypanosoma cruzi 13000 ChEMBL 10.7270/Q2J67MZ9 35189560 Beltran-Hortelano, I; Alcolea, V; Font, M; Pérez-Silanes, S Universidad de Navarra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50597991 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004647&target=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50597991&enzyme=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search 10766661 482608843 1 MASKPQPIAAANWKCNGSESLLVPLIETLNAATFDHDVQCVVAPTFLHIPMTKARLTNPKFQIAAQNAITRSGAFTGEVSLQILKDYGISWVVLGHSERRLYYGETNEIVAEKVAQACAAGFHVIVCVGETNEEREAGRTAAVVLTQLAAVAQKLSKEAWSRVVIAYEPVWAIGTGKVATPQQAQEVHELLRRWVRSKLGTDIAAQLRILYGGSVTAKNARTLYQMRDINGFLVGGASLKPEFVEIIEATK 1CI1,1SUX,1TCD,2OMA Triosephosphate isomerase, glycosomal TPIS_TRYCR P52270 51484014 Oc1ccc2[NH+]([O-])c3cc(Cl)c(Cl)cc3[NH+]([O-])c2c1 InChI=1S/C12H8Cl2N2O3/c13-7-4-11-12(5-8(7)14)16(19)10-3-6(17)1-2-9(10)15(11)18/h1-5,15-17H AJGGYMWCALORIZ-UHFFFAOYSA-N 50597992 CHEMBL5169735 Triosephosphate isomerase, glycosomal Trypanosoma cruzi 26000 ChEMBL 10.7270/Q2J67MZ9 35189560 Beltran-Hortelano, I; Alcolea, V; Font, M; Pérez-Silanes, S Universidad de Navarra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50597992 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004647&target=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50597992&enzyme=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search 168270097 482608844 1 MASKPQPIAAANWKCNGSESLLVPLIETLNAATFDHDVQCVVAPTFLHIPMTKARLTNPKFQIAAQNAITRSGAFTGEVSLQILKDYGISWVVLGHSERRLYYGETNEIVAEKVAQACAAGFHVIVCVGETNEEREAGRTAAVVLTQLAAVAQKLSKEAWSRVVIAYEPVWAIGTGKVATPQQAQEVHELLRRWVRSKLGTDIAAQLRILYGGSVTAKNARTLYQMRDINGFLVGGASLKPEFVEIIEATK 1CI1,1SUX,1TCD,2OMA Triosephosphate isomerase, glycosomal TPIS_TRYCR P52270 51484015 COc1ccc(cc1)-c1cc(=S)ss1 InChI=1S/C10H8OS3/c1-11-8-4-2-7(3-5-8)9-6-10(12)14-13-9/h2-6H,1H3 KYLIZBIRMBGUOP-UHFFFAOYSA-N 50597993 ANETHOLTRITHION::Anethole Trithione::Anethole trithione::Anetholtrithion::OP-2113::OP2113 Triosephosphate isomerase, glycosomal Trypanosoma cruzi 1200 ChEMBL 10.7270/Q2J67MZ9 35189560 Beltran-Hortelano, I; Alcolea, V; Font, M; Pérez-Silanes, S Universidad de Navarra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50597993 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004647&target=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50597993&enzyme=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search 2194 482608845 1 MASKPQPIAAANWKCNGSESLLVPLIETLNAATFDHDVQCVVAPTFLHIPMTKARLTNPKFQIAAQNAITRSGAFTGEVSLQILKDYGISWVVLGHSERRLYYGETNEIVAEKVAQACAAGFHVIVCVGETNEEREAGRTAAVVLTQLAAVAQKLSKEAWSRVVIAYEPVWAIGTGKVATPQQAQEVHELLRRWVRSKLGTDIAAQLRILYGGSVTAKNARTLYQMRDINGFLVGGASLKPEFVEIIEATK 1CI1,1SUX,1TCD,2OMA Triosephosphate isomerase, glycosomal TPIS_TRYCR P52270 51484016 [I-].COc1ccc(cc1)-c1c\c(ss1)=[S+]\CC(C)=O InChI=1S/C13H13O2S3.HI/c1-9(14)8-16-13-7-12(17-18-13)10-3-5-11(15-2)6-4-10;/h3-7H,8H2,1-2H3;1H/q+1;/p-1 NCKUHKUWOSMSDA-UHFFFAOYSA-M 50597994 CHEMBL5172018 Triosephosphate isomerase, glycosomal Trypanosoma cruzi 11000 ChEMBL 10.7270/Q2J67MZ9 35189560 Beltran-Hortelano, I; Alcolea, V; Font, M; Pérez-Silanes, S Universidad de Navarra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50597994 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004647&target=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50597994&enzyme=Triosephosphate+isomerase%2C+glycosomal&column=ki&startPg=0&Increment=50&submit=Search 168270788 482608846 1 MASKPQPIAAANWKCNGSESLLVPLIETLNAATFDHDVQCVVAPTFLHIPMTKARLTNPKFQIAAQNAITRSGAFTGEVSLQILKDYGISWVVLGHSERRLYYGETNEIVAEKVAQACAAGFHVIVCVGETNEEREAGRTAAVVLTQLAAVAQKLSKEAWSRVVIAYEPVWAIGTGKVATPQQAQEVHELLRRWVRSKLGTDIAAQLRILYGGSVTAKNARTLYQMRDINGFLVGGASLKPEFVEIIEATK 1CI1,1SUX,1TCD,2OMA Triosephosphate isomerase, glycosomal TPIS_TRYCR P52270