Found 8 hits of Enzyme Inhibition Constant Data Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kJ/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
Prothrombin
(Homo sapiens (Human)) | BDBM98168
(US8487111, 8)Show SMILES COCc1cc(ccc1-n1cccc(CCO)c1=O)N1C[C@H](CNC(=O)c2ccc(Cl)s2)OC1=O |r| Show InChI InChI=1S/C24H24ClN3O6S/c1-33-14-16-11-17(4-5-19(16)27-9-2-3-15(8-10-29)23(27)31)28-13-18(34-24(28)32)12-26-22(30)20-6-7-21(25)35-20/h2-7,9,11,18,29H,8,10,12-14H2,1H3,(H,26,30)/t18-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| US Patent
| n/a | n/a | 16 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Intellectual Property GmbH
US Patent
| Assay Description Thrombin inhibitory activity. |
US Patent US8487111 (2013)
BindingDB Entry DOI: 10.7270/Q29K48V9 |
More data for this Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM98166
(US8487111, 2)Show SMILES Cc1cc(ccc1-n1cccc(CO)c1=O)N1C[C@H](CNC(=O)c2ccc(Cl)s2)OC1=O |r| Show InChI InChI=1S/C22H20ClN3O5S/c1-13-9-15(4-5-17(13)25-8-2-3-14(12-27)21(25)29)26-11-16(31-22(26)30)10-24-20(28)18-6-7-19(23)32-18/h2-9,16,27H,10-12H2,1H3,(H,24,28)/t16-/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| US Patent
| n/a | n/a | 21 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Intellectual Property GmbH
US Patent
| Assay Description Factor Xa inhibitory activity. |
US Patent US8487111 (2013)
BindingDB Entry DOI: 10.7270/Q29K48V9 |
More data for this Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM98169
(US8487111, 10)Show SMILES Cc1cc(ccc1-n1cccc(CCCO)c1=O)N1C[C@H](CNC(=O)c2ccc(Cl)s2)OC1=O |r| Show InChI InChI=1S/C24H24ClN3O5S/c1-15-12-17(6-7-19(15)27-10-2-4-16(23(27)31)5-3-11-29)28-14-18(33-24(28)32)13-26-22(30)20-8-9-21(25)34-20/h2,4,6-10,12,18,29H,3,5,11,13-14H2,1H3,(H,26,30)/t18-/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| US Patent
| n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Intellectual Property GmbH
US Patent
| Assay Description Factor Xa inhibitory activity. |
US Patent US8487111 (2013)
BindingDB Entry DOI: 10.7270/Q29K48V9 |
More data for this Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM98167
(US8487111, 6)Show SMILES Cc1cc(ccc1-n1cccc(CCO)c1=O)N1C[C@H](CNC(=O)c2ccc(Cl)s2)OC1=O |r| Show InChI InChI=1S/C23H22ClN3O5S/c1-14-11-16(4-5-18(14)26-9-2-3-15(8-10-28)22(26)30)27-13-17(32-23(27)31)12-25-21(29)19-6-7-20(24)33-19/h2-7,9,11,17,28H,8,10,12-13H2,1H3,(H,25,29)/t17-/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| US Patent
| n/a | n/a | 70 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Intellectual Property GmbH
US Patent
| Assay Description Factor Xa inhibitory activity. |
US Patent US8487111 (2013)
BindingDB Entry DOI: 10.7270/Q29K48V9 |
More data for this Ligand-Target Pair | |
Prothrombin
(Homo sapiens (Human)) | BDBM98169
(US8487111, 10)Show SMILES Cc1cc(ccc1-n1cccc(CCCO)c1=O)N1C[C@H](CNC(=O)c2ccc(Cl)s2)OC1=O |r| Show InChI InChI=1S/C24H24ClN3O5S/c1-15-12-17(6-7-19(15)27-10-2-4-16(23(27)31)5-3-11-29)28-14-18(33-24(28)32)13-26-22(30)20-8-9-21(25)34-20/h2,4,6-10,12,18,29H,3,5,11,13-14H2,1H3,(H,26,30)/t18-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| US Patent
| n/a | n/a | 74 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Intellectual Property GmbH
US Patent
| Assay Description Thrombin inhibitory activity. |
US Patent US8487111 (2013)
BindingDB Entry DOI: 10.7270/Q29K48V9 |
More data for this Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM98168
(US8487111, 8)Show SMILES COCc1cc(ccc1-n1cccc(CCO)c1=O)N1C[C@H](CNC(=O)c2ccc(Cl)s2)OC1=O |r| Show InChI InChI=1S/C24H24ClN3O6S/c1-33-14-16-11-17(4-5-19(16)27-9-2-3-15(8-10-29)23(27)31)28-13-18(34-24(28)32)12-26-22(30)20-6-7-21(25)35-20/h2-7,9,11,18,29H,8,10,12-14H2,1H3,(H,26,30)/t18-/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| US Patent
| n/a | n/a | 167 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Intellectual Property GmbH
US Patent
| Assay Description Factor Xa inhibitory activity. |
US Patent US8487111 (2013)
BindingDB Entry DOI: 10.7270/Q29K48V9 |
More data for this Ligand-Target Pair | |
Prothrombin
(Homo sapiens (Human)) | BDBM98167
(US8487111, 6)Show SMILES Cc1cc(ccc1-n1cccc(CCO)c1=O)N1C[C@H](CNC(=O)c2ccc(Cl)s2)OC1=O |r| Show InChI InChI=1S/C23H22ClN3O5S/c1-14-11-16(4-5-18(14)26-9-2-3-15(8-10-28)22(26)30)27-13-17(32-23(27)31)12-25-21(29)19-6-7-20(24)33-19/h2-7,9,11,17,28H,8,10,12-13H2,1H3,(H,25,29)/t17-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| US Patent
| n/a | n/a | 186 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Intellectual Property GmbH
US Patent
| Assay Description Thrombin inhibitory activity. |
US Patent US8487111 (2013)
BindingDB Entry DOI: 10.7270/Q29K48V9 |
More data for this Ligand-Target Pair | |
Prothrombin
(Homo sapiens (Human)) | BDBM98166
(US8487111, 2)Show SMILES Cc1cc(ccc1-n1cccc(CO)c1=O)N1C[C@H](CNC(=O)c2ccc(Cl)s2)OC1=O |r| Show InChI InChI=1S/C22H20ClN3O5S/c1-13-9-15(4-5-17(13)25-8-2-3-14(12-27)21(25)29)26-11-16(31-22(26)30)10-24-20(28)18-6-7-19(23)32-18/h2-9,16,27H,10-12H2,1H3,(H,24,28)/t16-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| US Patent
| n/a | n/a | 198 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Intellectual Property GmbH
US Patent
| Assay Description Thrombin inhibitory activity. |
US Patent US8487111 (2013)
BindingDB Entry DOI: 10.7270/Q29K48V9 |
More data for this Ligand-Target Pair | |