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 51414401 CN(CC=C)C\C=C(/C)CC\C=C(/C)CCC=C(C)C InChI=1S/C19H33N/c1-7-15-20(6)16-14-19(5)13-9-12-18(4)11-8-10-17(2)3/h7,10,12,14H,1,8-9,11,13,15-16H2,2-6H3/b18-12+,19-14+ FQILZBBMBPPIJB-IJNKXORISA-N 50571292 CHEMBL4873171 1,4-dihydroxy-2-naphthoate octaprenyltransferase 19900 ChEMBL 10.1016/j.bmcl.2021.128203 10.7270/Q2QR51WP 34139327 Choi, SR; Narayanasamy, P University of Nebraska Medical Center http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50571292 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50571292&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 6434915 471061437 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51414402 CC(C)=CCC\C(C)=C\CC\C(C)=C\COC(=O)C(N)CC(O)=O InChI=1S/C19H31NO4/c1-14(2)7-5-8-15(3)9-6-10-16(4)11-12-24-19(23)17(20)13-18(21)22/h7,9,11,17H,5-6,8,10,12-13,20H2,1-4H3,(H,21,22)/b15-9+,16-11+ MUMWHPZVRGSLMO-XGGJEREUSA-N 50571293 CHEMBL4859546 1,4-dihydroxy-2-naphthoate octaprenyltransferase 5330 ChEMBL 10.1016/j.bmcl.2021.128203 10.7270/Q2QR51WP 34139327 Choi, SR; Narayanasamy, P University of Nebraska Medical Center http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50571293 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50571293&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 164613741 471061438 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51414403 COc1ccc2ccc(OCCCCCCCCN(C)CC=C)cc2c1 InChI=1S/C23H33NO2/c1-4-15-24(2)16-9-7-5-6-8-10-17-26-23-14-12-20-11-13-22(25-3)18-21(20)19-23/h4,11-14,18-19H,1,5-10,15-17H2,2-3H3 LLIRANLCBIKPTD-UHFFFAOYSA-N 50571294 CHEMBL4879210 1,4-dihydroxy-2-naphthoate octaprenyltransferase 16800 ChEMBL 10.1016/j.bmcl.2021.128203 10.7270/Q2QR51WP 34139327 Choi, SR; Narayanasamy, P University of Nebraska Medical Center http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50571294 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50571294&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 134815050 471061439 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51414404 COc1ccc2ccc(OCCCCCCCCN3CCCCC3)cc2c1 InChI=1S/C24H35NO2/c1-26-23-13-11-21-12-14-24(20-22(21)19-23)27-18-10-5-3-2-4-7-15-25-16-8-6-9-17-25/h11-14,19-20H,2-10,15-18H2,1H3 OEEZZNPPUDSSLS-UHFFFAOYSA-N 50571295 CHEMBL4858817 1,4-dihydroxy-2-naphthoate octaprenyltransferase 13500 ChEMBL 10.1016/j.bmcl.2021.128203 10.7270/Q2QR51WP 34139327 Choi, SR; Narayanasamy, P University of Nebraska Medical Center http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50571295 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50571295&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 134815051 471061440 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51549453 COc1ccc2ccc(OCCCCCCCCN(C)CC=C)cc2c1 InChI=1S/C23H33NO2/c1-4-15-24(2)16-9-7-5-6-8-10-17-26-23-14-12-20-11-13-22(25-3)18-21(20)19-23/h4,11-14,18-19H,1,5-10,15-17H2,2-3H3 LLIRANLCBIKPTD-UHFFFAOYSA-N 50571294 CHEMBL4879210 1,4-dihydroxy-2-naphthoate octaprenyltransferase Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) 16900 ChEMBL 10.1016/j.ejmech.2023.115125 10.7270/Q2DN49FZ 36682292 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50571294 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50571294&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 134815050 471061439 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51549454 COc1ccc2ccc(OCCCCCCCCN3CCCCC3)cc2c1 InChI=1S/C24H35NO2/c1-26-23-13-11-21-12-14-24(20-22(21)19-23)27-18-10-5-3-2-4-7-15-25-16-8-6-9-17-25/h11-14,19-20H,2-10,15-18H2,1H3 OEEZZNPPUDSSLS-UHFFFAOYSA-N 50571295 CHEMBL4858817 1,4-dihydroxy-2-naphthoate octaprenyltransferase Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) 13500 ChEMBL 10.1016/j.ejmech.2023.115125 10.7270/Q2DN49FZ 36682292 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50571295 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50571295&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 134815051 471061440 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51549455 CCCN(C)c1ccc(CN2CCC(COc3nc4ccc(F)cc4s3)CC2)cc1 InChI=1S/C24H30FN3OS/c1-3-12-27(2)21-7-4-18(5-8-21)16-28-13-10-19(11-14-28)17-29-24-26-22-9-6-20(25)15-23(22)30-24/h4-9,15,19H,3,10-14,16-17H2,1-2H3 BBNQCSRNZQOXJR-UHFFFAOYSA-N 50623216 CHEMBL5422609 1,4-dihydroxy-2-naphthoate octaprenyltransferase Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) 31000 ChEMBL 10.1016/j.ejmech.2023.115125 10.7270/Q2DN49FZ 36682292 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623216 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623216&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51549456 CCCN(C)c1ccc(CN2CCC(CSc3ccccc3)CC2)cc1 InChI=1S/C23H32N2S/c1-3-15-24(2)22-11-9-20(10-12-22)18-25-16-13-21(14-17-25)19-26-23-7-5-4-6-8-23/h4-12,21H,3,13-19H2,1-2H3 LAAUOGGEFFTQCD-UHFFFAOYSA-N 50623217 CHEMBL5416104 1,4-dihydroxy-2-naphthoate octaprenyltransferase Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) 18000 ChEMBL 10.1016/j.ejmech.2023.115125 10.7270/Q2DN49FZ 36682292 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623217 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623217&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51549457 C(Oc1cccc(Oc2ccccc2)c1)C1CCN(Cc2ccc(cc2)N2CCOCC2)CC1 InChI=1S/C29H34N2O3/c1-2-5-27(6-3-1)34-29-8-4-7-28(21-29)33-23-25-13-15-30(16-14-25)22-24-9-11-26(12-10-24)31-17-19-32-20-18-31/h1-12,21,25H,13-20,22-23H2 QRSIBVGVNIYOFX-UHFFFAOYSA-N 50623218 CHEMBL5422527 1,4-dihydroxy-2-naphthoate octaprenyltransferase Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) 25000 ChEMBL 10.1016/j.ejmech.2023.115125 10.7270/Q2DN49FZ 36682292 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623218 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623218&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51549458 CCCN(C)c1ccc(CN2[C@H]3CC[C@@H]2CC(C3)Oc2cccc(Oc3ccccc3)c2)cc1 InChI=1S/C30H36N2O2/c1-3-18-31(2)24-14-12-23(13-15-24)22-32-25-16-17-26(32)20-30(19-25)34-29-11-7-10-28(21-29)33-27-8-5-4-6-9-27/h4-15,21,25-26,30H,3,16-20,22H2,1-2H3/t25-,26+,30? NFTUAILDFKCNPZ-ZAWMEEFFSA-N 50623219 CHEMBL5432673 1,4-dihydroxy-2-naphthoate octaprenyltransferase Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) 27000 ChEMBL 10.1016/j.ejmech.2023.115125 10.7270/Q2DN49FZ 36682292 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623219 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623219&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51549459 CCCN(C)c1ccc(CN2CCC3(CC(CO3)Oc3cccc(Oc4ccccc4)c3)CC2)cc1 InChI=1S/C31H38N2O3/c1-3-18-32(2)26-14-12-25(13-15-26)23-33-19-16-31(17-20-33)22-30(24-34-31)36-29-11-7-10-28(21-29)35-27-8-5-4-6-9-27/h4-15,21,30H,3,16-20,22-24H2,1-2H3 IGKWQNSSYKKOJI-UHFFFAOYSA-N 50623220 CHEMBL5412422 1,4-dihydroxy-2-naphthoate octaprenyltransferase Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) 25000 ChEMBL 10.1016/j.ejmech.2023.115125 10.7270/Q2DN49FZ 36682292 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623220 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623220&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51549460 CCCN(C)c1ccc(CN2CCC3(CC(CO3)Oc3ccc(Cl)cc3)CC2)cc1 InChI=1S/C25H33ClN2O2/c1-3-14-27(2)22-8-4-20(5-9-22)18-28-15-12-25(13-16-28)17-24(19-29-25)30-23-10-6-21(26)7-11-23/h4-11,24H,3,12-19H2,1-2H3 CWANQFXDKKSEFR-UHFFFAOYSA-N 50623221 CHEMBL5434510 1,4-dihydroxy-2-naphthoate octaprenyltransferase Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) >50000 ChEMBL 10.1016/j.ejmech.2023.115125 10.7270/Q2DN49FZ 36682292 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623221 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623221&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51549461 CCCN(C)c1ccc(CN2CCCC(C2)Oc2cccc(Oc3ccccc3)c2)cc1 InChI=1S/C28H34N2O2/c1-3-18-29(2)24-16-14-23(15-17-24)21-30-19-8-13-28(22-30)32-27-12-7-11-26(20-27)31-25-9-5-4-6-10-25/h4-7,9-12,14-17,20,28H,3,8,13,18-19,21-22H2,1-2H3 AHNKRVIKBJXBLP-UHFFFAOYSA-N 50623222 CHEMBL5424914 1,4-dihydroxy-2-naphthoate octaprenyltransferase Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) 24000 ChEMBL 10.1016/j.ejmech.2023.115125 10.7270/Q2DN49FZ 36682292 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623222 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623222&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51549462 CCCN(C)c1ccc(CN2C[C@@H]3C[C@H]2CN3Cc2ccc(cc2)N2CCOCC2)cc1 InChI=1S/C27H38N4O/c1-3-12-28(2)24-8-4-22(5-9-24)18-30-20-27-17-26(30)21-31(27)19-23-6-10-25(11-7-23)29-13-15-32-16-14-29/h4-11,26-27H,3,12-21H2,1-2H3/t26-,27-/m0/s1 IHOMOCRHMVJRKV-SVBPBHIXSA-N 50623223 CHEMBL5419972 1,4-dihydroxy-2-naphthoate octaprenyltransferase Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) >50000 ChEMBL 10.1016/j.ejmech.2023.115125 10.7270/Q2DN49FZ 36682292 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623223 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623223&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51549463 CCCN(C)c1ccc(CN2CCC(COc3cccc(c3)C(=O)c3ccc(Cl)cc3)CC2)cc1 InChI=1S/C30H35ClN2O2/c1-3-17-32(2)28-13-7-23(8-14-28)21-33-18-15-24(16-19-33)22-35-29-6-4-5-26(20-29)30(34)25-9-11-27(31)12-10-25/h4-14,20,24H,3,15-19,21-22H2,1-2H3 CXXLROSCZWRIJR-UHFFFAOYSA-N 50623224 CHEMBL5400835 1,4-dihydroxy-2-naphthoate octaprenyltransferase Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) 14000 ChEMBL 10.1016/j.ejmech.2023.115125 10.7270/Q2DN49FZ 36682292 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623224 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623224&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51549464 CCCN(C)c1ccc(CN2CCC(COc3cccc(Oc4ccccc4)c3)CC2)cc1 InChI=1S/C29H36N2O2/c1-3-18-30(2)26-14-12-24(13-15-26)22-31-19-16-25(17-20-31)23-32-28-10-7-11-29(21-28)33-27-8-5-4-6-9-27/h4-15,21,25H,3,16-20,22-23H2,1-2H3 LTXOHYSJUBYNSE-UHFFFAOYSA-N 50623225 CHEMBL5428326 1,4-dihydroxy-2-naphthoate octaprenyltransferase Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) 13000 ChEMBL 10.1016/j.ejmech.2023.115125 10.7270/Q2DN49FZ 36682292 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623225 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623225&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51549465 CCCN(C)c1ccc(CN2CCC(COc3cccc(Nc4ccccc4C)c3)CC2)cc1 InChI=1S/C30H39N3O/c1-4-18-32(3)28-14-12-25(13-15-28)22-33-19-16-26(17-20-33)23-34-29-10-7-9-27(21-29)31-30-11-6-5-8-24(30)2/h5-15,21,26,31H,4,16-20,22-23H2,1-3H3 NCVCHKCVEBCEBO-UHFFFAOYSA-N 50623226 CHEMBL5416452 1,4-dihydroxy-2-naphthoate octaprenyltransferase Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) 22000 ChEMBL 10.1016/j.ejmech.2023.115125 10.7270/Q2DN49FZ 36682292 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623226 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623226&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51549466 CCCN(C)c1ccc(CN2CCC(COc3cccc(Cc4ccc(Cl)cc4)c3)CC2)cc1 InChI=1S/C30H37ClN2O/c1-3-17-32(2)29-13-9-25(10-14-29)22-33-18-15-26(16-19-33)23-34-30-6-4-5-27(21-30)20-24-7-11-28(31)12-8-24/h4-14,21,26H,3,15-20,22-23H2,1-2H3 ITMUPTQJUPTTPU-UHFFFAOYSA-N 50623227 CHEMBL5422572 1,4-dihydroxy-2-naphthoate octaprenyltransferase Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) 55000 ChEMBL 10.1016/j.ejmech.2023.115125 10.7270/Q2DN49FZ 36682292 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623227 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623227&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51549467 CCCN(C)c1ccc(CN2CCC(COc3cc(=O)n(C)c4ccccc34)CC2)cc1 InChI=1S/C27H35N3O2/c1-4-15-28(2)23-11-9-21(10-12-23)19-30-16-13-22(14-17-30)20-32-26-18-27(31)29(3)25-8-6-5-7-24(25)26/h5-12,18,22H,4,13-17,19-20H2,1-3H3 QULOWEOGHXGEKP-UHFFFAOYSA-N 50623228 CHEMBL5422039 1,4-dihydroxy-2-naphthoate octaprenyltransferase Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) 102000 ChEMBL 10.1016/j.ejmech.2023.115125 10.7270/Q2DN49FZ 36682292 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623228 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623228&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51549468 CCCN(C)c1ccc(CN2CCC(COc3ccc4ccccc4c3)CC2)cc1 InChI=1S/C27H34N2O/c1-3-16-28(2)26-11-8-22(9-12-26)20-29-17-14-23(15-18-29)21-30-27-13-10-24-6-4-5-7-25(24)19-27/h4-13,19,23H,3,14-18,20-21H2,1-2H3 RCGMWCXCJULISX-UHFFFAOYSA-N 50623229 CHEMBL5394436 1,4-dihydroxy-2-naphthoate octaprenyltransferase Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) 21000 ChEMBL 10.1016/j.ejmech.2023.115125 10.7270/Q2DN49FZ 36682292 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623229 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623229&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51549469 CCCN(C)c1ccc(CN2CCC(COc3ccccc3)CC2)cc1 InChI=1S/C23H32N2O/c1-3-15-24(2)22-11-9-20(10-12-22)18-25-16-13-21(14-17-25)19-26-23-7-5-4-6-8-23/h4-12,21H,3,13-19H2,1-2H3 CREUWGITZLTZDV-UHFFFAOYSA-N 50623230 CHEMBL5408216 1,4-dihydroxy-2-naphthoate octaprenyltransferase Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) 64000 ChEMBL 10.1016/j.ejmech.2023.115125 10.7270/Q2DN49FZ 36682292 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623230 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623230&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51549470 CCCN(C)c1ccc(CN2CCC(COc3ccc(F)cc3)CC2)cc1 InChI=1S/C23H31FN2O/c1-3-14-25(2)22-8-4-19(5-9-22)17-26-15-12-20(13-16-26)18-27-23-10-6-21(24)7-11-23/h4-11,20H,3,12-18H2,1-2H3 UQCNJWXEWAYSRR-UHFFFAOYSA-N 50623231 CHEMBL5394336 1,4-dihydroxy-2-naphthoate octaprenyltransferase Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) 33000 ChEMBL 10.1016/j.ejmech.2023.115125 10.7270/Q2DN49FZ 36682292 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623231 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623231&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51549471 CCCN(C)c1ccc(CN2CCC(COc3ccc(Br)cc3)CC2)cc1 InChI=1S/C23H31BrN2O/c1-3-14-25(2)22-8-4-19(5-9-22)17-26-15-12-20(13-16-26)18-27-23-10-6-21(24)7-11-23/h4-11,20H,3,12-18H2,1-2H3 YJVDVIITONLFPF-UHFFFAOYSA-N 50623232 CHEMBL5428010 1,4-dihydroxy-2-naphthoate octaprenyltransferase Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) 12000 ChEMBL 10.1016/j.ejmech.2023.115125 10.7270/Q2DN49FZ 36682292 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623232 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623232&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51549472 CCCN(C)c1ccc(CN2CCC(COc3ccc(Cl)cc3)CC2)cc1 InChI=1S/C23H31ClN2O/c1-3-14-25(2)22-8-4-19(5-9-22)17-26-15-12-20(13-16-26)18-27-23-10-6-21(24)7-11-23/h4-11,20H,3,12-18H2,1-2H3 IELKIDMEJICGCF-UHFFFAOYSA-N 50623233 CHEMBL5399952 1,4-dihydroxy-2-naphthoate octaprenyltransferase Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) 22000 ChEMBL 10.1016/j.ejmech.2023.115125 10.7270/Q2DN49FZ 36682292 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623233 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623233&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51549473 CCCN(C)c1ccc(CN2CCC(COc3ccccc3F)CC2)cc1 InChI=1S/C23H31FN2O/c1-3-14-25(2)21-10-8-19(9-11-21)17-26-15-12-20(13-16-26)18-27-23-7-5-4-6-22(23)24/h4-11,20H,3,12-18H2,1-2H3 NRLFYWOJKKPSAX-UHFFFAOYSA-N 50623234 CHEMBL5420782 1,4-dihydroxy-2-naphthoate octaprenyltransferase Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) 18000 ChEMBL 10.1016/j.ejmech.2023.115125 10.7270/Q2DN49FZ 36682292 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623234 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623234&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51549474 CCCN(C)c1ccc(CN2CCC(COc3ccccc3Cl)CC2)cc1 InChI=1S/C23H31ClN2O/c1-3-14-25(2)21-10-8-19(9-11-21)17-26-15-12-20(13-16-26)18-27-23-7-5-4-6-22(23)24/h4-11,20H,3,12-18H2,1-2H3 KJHHHSGYRVGQOE-UHFFFAOYSA-N 50623235 CHEMBL5406647 1,4-dihydroxy-2-naphthoate octaprenyltransferase Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) 31000 ChEMBL 10.1016/j.ejmech.2023.115125 10.7270/Q2DN49FZ 36682292 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623235 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623235&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51549475 CCCN(C)c1ccc(CN2CCC(COc3cccc(Br)c3)CC2)cc1 InChI=1S/C23H31BrN2O/c1-3-13-25(2)22-9-7-19(8-10-22)17-26-14-11-20(12-15-26)18-27-23-6-4-5-21(24)16-23/h4-10,16,20H,3,11-15,17-18H2,1-2H3 ORLWTQYPVOGUSG-UHFFFAOYSA-N 50623236 CHEMBL5433256 1,4-dihydroxy-2-naphthoate octaprenyltransferase Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) 12000 ChEMBL 10.1016/j.ejmech.2023.115125 10.7270/Q2DN49FZ 36682292 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623236 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623236&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51549476 CCCN(C)c1ccc(CN2CCC(COc3ccc(Cl)cc3Cl)CC2)cc1 InChI=1S/C23H30Cl2N2O/c1-3-12-26(2)21-7-4-18(5-8-21)16-27-13-10-19(11-14-27)17-28-23-9-6-20(24)15-22(23)25/h4-9,15,19H,3,10-14,16-17H2,1-2H3 GCVSXTNABUUMAM-UHFFFAOYSA-N 50623237 CHEMBL5412545 1,4-dihydroxy-2-naphthoate octaprenyltransferase Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) 25000 ChEMBL 10.1016/j.ejmech.2023.115125 10.7270/Q2DN49FZ 36682292 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623237 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623237&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51549477 CCCN(C)c1ccc(CN2CCC(COc3c(F)cccc3F)CC2)cc1 InChI=1S/C23H30F2N2O/c1-3-13-26(2)20-9-7-18(8-10-20)16-27-14-11-19(12-15-27)17-28-23-21(24)5-4-6-22(23)25/h4-10,19H,3,11-17H2,1-2H3 CURLTFLVQSTJTM-UHFFFAOYSA-N 50623238 CHEMBL5417487 1,4-dihydroxy-2-naphthoate octaprenyltransferase Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) 25000 ChEMBL 10.1016/j.ejmech.2023.115125 10.7270/Q2DN49FZ 36682292 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623238 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623238&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51549478 CCCN(C)c1ccc(CN2CCC(COC3[C@H]4C[C@@H]5C[C@@H](C[C@H]3C5)C4)CC2)cc1 InChI=1S/C27H42N2O/c1-3-10-28(2)26-6-4-20(5-7-26)18-29-11-8-21(9-12-29)19-30-27-24-14-22-13-23(16-24)17-25(27)15-22/h4-7,21-25,27H,3,8-19H2,1-2H3/t22-,23+,24-,25+,27? RFTJDVBANVUTOE-BOPPWTAWSA-N 50623239 CHEMBL5420324 1,4-dihydroxy-2-naphthoate octaprenyltransferase Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) 23000 ChEMBL 10.1016/j.ejmech.2023.115125 10.7270/Q2DN49FZ 36682292 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623239 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623239&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51549479 CCCN(C)c1ccc(CN2CCC(COc3ccc(C)cn3)CC2)cc1 InChI=1S/C23H33N3O/c1-4-13-25(3)22-8-6-20(7-9-22)17-26-14-11-21(12-15-26)18-27-23-10-5-19(2)16-24-23/h5-10,16,21H,4,11-15,17-18H2,1-3H3 MZTMVBGFOUNCRM-UHFFFAOYSA-N 50623240 CHEMBL5408015 1,4-dihydroxy-2-naphthoate octaprenyltransferase Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) >50000 ChEMBL 10.1016/j.ejmech.2023.115125 10.7270/Q2DN49FZ 36682292 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623240 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623240&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650 51549480 CCCN(C)c1ccc(CN2CCC(COc3ccc(OC)cc3)CC2)cc1 InChI=1S/C24H34N2O2/c1-4-15-25(2)22-7-5-20(6-8-22)18-26-16-13-21(14-17-26)19-28-24-11-9-23(27-3)10-12-24/h5-12,21H,4,13-19H2,1-3H3 HGXOJTDGGCKUMK-UHFFFAOYSA-N 50623241 CHEMBL5415694 1,4-dihydroxy-2-naphthoate octaprenyltransferase Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) 25000 ChEMBL 10.1016/j.ejmech.2023.115125 10.7270/Q2DN49FZ 36682292 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623241 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001036&target=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623241&enzyme=1%2C4-dihydroxy-2-naphthoate+octaprenyltransferase&column=ki&startPg=0&Increment=50&submit=Search 1 MASFAQWVSGARPRTLPNAIAPVVAGTGAAAWLHAAVWWKALLALAVAVALVIGVNYANDYSDGIRGTDDDRVGPVRLVGSRLATPRSVLTAAMTSLALGALAGLVLALLSAPWLIAVGAICIAGAWLYTGGSKPYGYAGFGELAVFVFFGPVAVLGTQYTQALRVDWVGLAQAVATGALSCSVLVANNLRDIPTDARADKITLAVRLGDARTRMLYQGLLAVAGVLTFVLMLATPWCVVGLVAAPLALRAAGPVRSGRGGRELIPVLRDTGLAMLVWALAVAGALAFGQLS 1,4-dihydroxy-2-naphthoate octaprenyltransferase MENA_MYCTU P9WIP3 L0T6Z2 O06400 P65650