Found 10 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 |
Coagulation factor VII
(Homo sapiens (Human)) | BDBM50437440
(CHEMBL2409219)Show SMILES COc1cc([C@@H]2Nc3ccc(cc3[C@@H]3[C@H]2Cc2ccccc32)C(N)=N)c(cc1O)-c1ccccc1C(O)=O |r| Show InChI InChI=1S/C31H27N3O4/c1-38-27-15-22(21(14-26(27)35)19-8-4-5-9-20(19)31(36)37)29-24-12-16-6-2-3-7-18(16)28(24)23-13-17(30(32)33)10-11-25(23)34-29/h2-11,13-15,24,28-29,34-35H,12H2,1H3,(H3,32,33)(H,36,37)/t24-,28-,29+/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.620 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research Institute
Curated by ChEMBL
| Assay Description Inhibition of recombinant human coagulation factor 7A |
Bioorg Med Chem Lett 23: 2432-5 (2013)
Article DOI: 10.1016/j.bmcl.2013.02.013 BindingDB Entry DOI: 10.7270/Q2R78GN6 |
More data for this Ligand-Target Pair | |
Coagulation factor VII
(Homo sapiens (Human)) | BDBM50437438
(CHEMBL2409314)Show SMILES COc1cc([C@@H]2Nc3ccc(cc3[C@@H]3[C@H]2Cc2ccccc32)C(N)=N)c(cc1O)-c1ccc(cc1)C(O)=O |r| Show InChI InChI=1S/C31H27N3O4/c1-38-27-15-22(21(14-26(27)35)16-6-8-17(9-7-16)31(36)37)29-24-12-18-4-2-3-5-20(18)28(24)23-13-19(30(32)33)10-11-25(23)34-29/h2-11,13-15,24,28-29,34-35H,12H2,1H3,(H3,32,33)(H,36,37)/t24-,28-,29+/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE MMDB PC cid PC sid PDB UniChem
Similars
| PDB Article PubMed
| 1.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research Institute
Curated by ChEMBL
| Assay Description Inhibition of recombinant human coagulation factor 7A |
Bioorg Med Chem Lett 23: 2432-5 (2013)
Article DOI: 10.1016/j.bmcl.2013.02.013 BindingDB Entry DOI: 10.7270/Q2R78GN6 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Coagulation factor VII
(Homo sapiens (Human)) | BDBM50437439
(CHEMBL2409220)Show SMILES COc1cc([C@@H]2Nc3ccc(cc3[C@@H]3[C@H]2Cc2ccccc32)C(N)=N)c(cc1O)-c1cccc(c1)C(O)=O |r| Show InChI InChI=1S/C31H27N3O4/c1-38-27-15-22(21(14-26(27)35)16-6-4-7-19(11-16)31(36)37)29-24-12-17-5-2-3-8-20(17)28(24)23-13-18(30(32)33)9-10-25(23)34-29/h2-11,13-15,24,28-29,34-35H,12H2,1H3,(H3,32,33)(H,36,37)/t24-,28-,29+/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 8.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research Institute
Curated by ChEMBL
| Assay Description Inhibition of recombinant human coagulation factor 7A |
Bioorg Med Chem Lett 23: 2432-5 (2013)
Article DOI: 10.1016/j.bmcl.2013.02.013 BindingDB Entry DOI: 10.7270/Q2R78GN6 |
More data for this Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50437440
(CHEMBL2409219)Show SMILES COc1cc([C@@H]2Nc3ccc(cc3[C@@H]3[C@H]2Cc2ccccc32)C(N)=N)c(cc1O)-c1ccccc1C(O)=O |r| Show InChI InChI=1S/C31H27N3O4/c1-38-27-15-22(21(14-26(27)35)19-8-4-5-9-20(19)31(36)37)29-24-12-16-6-2-3-7-18(16)28(24)23-13-17(30(32)33)10-11-25(23)34-29/h2-11,13-15,24,28-29,34-35H,12H2,1H3,(H3,32,33)(H,36,37)/t24-,28-,29+/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 16 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research Institute
Curated by ChEMBL
| Assay Description Inhibition of purified human coagulation factor 10a |
Bioorg Med Chem Lett 23: 2432-5 (2013)
Article DOI: 10.1016/j.bmcl.2013.02.013 BindingDB Entry DOI: 10.7270/Q2R78GN6 |
More data for this Ligand-Target Pair | |
Coagulation factor VII
(Homo sapiens (Human)) | BDBM50437441
(CHEMBL2409218)Show SMILES COc1cc(ccc1O)[C@@H]1Nc2ccc(cc2[C@@H]2[C@H]1Cc1ccccc21)C(N)=N |r| Show InChI InChI=1S/C24H23N3O2/c1-29-21-12-14(7-9-20(21)28)23-18-10-13-4-2-3-5-16(13)22(18)17-11-15(24(25)26)6-8-19(17)27-23/h2-9,11-12,18,22-23,27-28H,10H2,1H3,(H3,25,26)/t18-,22-,23+/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 160 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research Institute
Curated by ChEMBL
| Assay Description Inhibition of recombinant human coagulation factor 7A |
Bioorg Med Chem Lett 23: 2432-5 (2013)
Article DOI: 10.1016/j.bmcl.2013.02.013 BindingDB Entry DOI: 10.7270/Q2R78GN6 |
More data for this Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50437441
(CHEMBL2409218)Show SMILES COc1cc(ccc1O)[C@@H]1Nc2ccc(cc2[C@@H]2[C@H]1Cc1ccccc21)C(N)=N |r| Show InChI InChI=1S/C24H23N3O2/c1-29-21-12-14(7-9-20(21)28)23-18-10-13-4-2-3-5-16(13)22(18)17-11-15(24(25)26)6-8-19(17)27-23/h2-9,11-12,18,22-23,27-28H,10H2,1H3,(H3,25,26)/t18-,22-,23+/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >500 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research Institute
Curated by ChEMBL
| Assay Description Inhibition of purified human coagulation factor 10a |
Bioorg Med Chem Lett 23: 2432-5 (2013)
Article DOI: 10.1016/j.bmcl.2013.02.013 BindingDB Entry DOI: 10.7270/Q2R78GN6 |
More data for this Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50437438
(CHEMBL2409314)Show SMILES COc1cc([C@@H]2Nc3ccc(cc3[C@@H]3[C@H]2Cc2ccccc32)C(N)=N)c(cc1O)-c1ccc(cc1)C(O)=O |r| Show InChI InChI=1S/C31H27N3O4/c1-38-27-15-22(21(14-26(27)35)16-6-8-17(9-7-16)31(36)37)29-24-12-18-4-2-3-5-20(18)28(24)23-13-19(30(32)33)10-11-25(23)34-29/h2-11,13-15,24,28-29,34-35H,12H2,1H3,(H3,32,33)(H,36,37)/t24-,28-,29+/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE MMDB PC cid PC sid PDB UniChem
Similars
| Article PubMed
| 1.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research Institute
Curated by ChEMBL
| Assay Description Inhibition of purified human coagulation factor 10a |
Bioorg Med Chem Lett 23: 2432-5 (2013)
Article DOI: 10.1016/j.bmcl.2013.02.013 BindingDB Entry DOI: 10.7270/Q2R78GN6 |
More data for this Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50437439
(CHEMBL2409220)Show SMILES COc1cc([C@@H]2Nc3ccc(cc3[C@@H]3[C@H]2Cc2ccccc32)C(N)=N)c(cc1O)-c1cccc(c1)C(O)=O |r| Show InChI InChI=1S/C31H27N3O4/c1-38-27-15-22(21(14-26(27)35)16-6-4-7-19(11-16)31(36)37)29-24-12-17-5-2-3-8-20(17)28(24)23-13-18(30(32)33)9-10-25(23)34-29/h2-11,13-15,24,28-29,34-35H,12H2,1H3,(H3,32,33)(H,36,37)/t24-,28-,29+/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 1.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research Institute
Curated by ChEMBL
| Assay Description Inhibition of purified human coagulation factor 10a |
Bioorg Med Chem Lett 23: 2432-5 (2013)
Article DOI: 10.1016/j.bmcl.2013.02.013 BindingDB Entry DOI: 10.7270/Q2R78GN6 |
More data for this Ligand-Target Pair | |
Coagulation factor VII
(Homo sapiens (Human)) | BDBM50437442
(CHEMBL2409316)Show SMILES COc1cc(ccc1O)[C@H]1C[C@H](c2ccccc2)c2cc(ccc2N1)C(N)=N |r| Show InChI InChI=1S/C23H23N3O2/c1-28-22-12-15(8-10-21(22)27)20-13-17(14-5-3-2-4-6-14)18-11-16(23(24)25)7-9-19(18)26-20/h2-12,17,20,26-27H,13H2,1H3,(H3,24,25)/t17-,20-/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 1.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research Institute
Curated by ChEMBL
| Assay Description Inhibition of recombinant human coagulation factor 7A |
Bioorg Med Chem Lett 23: 2432-5 (2013)
Article DOI: 10.1016/j.bmcl.2013.02.013 BindingDB Entry DOI: 10.7270/Q2R78GN6 |
More data for this Ligand-Target Pair | |
Coagulation factor VII
(Homo sapiens (Human)) | BDBM50437443
(CHEMBL2409315)Show SMILES C[C@@]1(C[C@@H](Nc2ccc(cc12)C(N)=N)c1ccc(O)cc1)c1ccccc1 |r| Show InChI InChI=1S/C23H23N3O/c1-23(17-5-3-2-4-6-17)14-21(15-7-10-18(27)11-8-15)26-20-12-9-16(22(24)25)13-19(20)23/h2-13,21,26-27H,14H2,1H3,(H3,24,25)/t21-,23-/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 8.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research Institute
Curated by ChEMBL
| Assay Description Inhibition of recombinant human coagulation factor 7A |
Bioorg Med Chem Lett 23: 2432-5 (2013)
Article DOI: 10.1016/j.bmcl.2013.02.013 BindingDB Entry DOI: 10.7270/Q2R78GN6 |
More data for this Ligand-Target Pair | |