Compile Data Set for Download or QSAR

Found 30 hits Enz. Inhib. hit(s) with all data for entry = 1859   

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))	BDBM14597 (2-[3-Amino-3-fluoro-4-(isopropylamino)-1,1-bipheny...) Show SMILES CC(C)Nc1ccc(-c2cccc(N)c2)c(CC(=O)NCc2ccc(cc2)C(N)=N)c1F Show InChI InChI=1S/C25H28FN5O/c1-15(2)31-22-11-10-20(18-4-3-5-19(27)12-18)21(24(22)26)13-23(32)30-14-16-6-8-17(9-7-16)25(28)29/h3-12,15,31H,13-14,27H2,1-2H3,(H3,28,29)(H,30,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	340	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Recombinant human Factor VIIa and soluble tissue factor were added to a 96-well assay plate containing substrate and inhibitor in reaction buffer. Th...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Coagulation factor VII (Homo sapiens (Human))	BDBM14596 (2-[3-Amino-4-(benzylamino)-3-fluoro-1,1-biphenyl-2...) Show SMILES NC(=N)c1ccc(CNC(=O)Cc2c(F)c(NCc3ccccc3)ccc2-c2cccc(N)c2)cc1 Show InChI InChI=1S/C29H28FN5O/c30-28-25(16-27(36)35-18-20-9-11-21(12-10-20)29(32)33)24(22-7-4-8-23(31)15-22)13-14-26(28)34-17-19-5-2-1-3-6-19/h1-15,34H,16-18,31H2,(H3,32,33)(H,35,36)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	500	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Recombinant human Factor VIIa and soluble tissue factor were added to a 96-well assay plate containing substrate and inhibitor in reaction buffer. Th...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM14597 (2-[3-Amino-3-fluoro-4-(isopropylamino)-1,1-bipheny...) Show SMILES CC(C)Nc1ccc(-c2cccc(N)c2)c(CC(=O)NCc2ccc(cc2)C(N)=N)c1F Show InChI InChI=1S/C25H28FN5O/c1-15(2)31-22-11-10-20(18-4-3-5-19(27)12-18)21(24(22)26)13-23(32)30-14-16-6-8-17(9-7-16)25(28)29/h3-12,15,31H,13-14,27H2,1-2H3,(H3,28,29)(H,30,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	950	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Human thrombin and substrate were added to a 96-well assay plate containing inhibitor in reaction buffer. The rate of hydrolysis of the substrate was...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM14594 (N-[(4-carbamimidoylphenyl)methyl]-2-{2,6-difluoro-...) Show SMILES NC(=N)c1ccc(CNC(=O)Cc2c(F)ccc(NCCc3ccccc3)c2F)cc1 Show InChI InChI=1S/C24H24F2N4O/c25-20-10-11-21(29-13-12-16-4-2-1-3-5-16)23(26)19(20)14-22(31)30-15-17-6-8-18(9-7-17)24(27)28/h1-11,29H,12-15H2,(H3,27,28)(H,30,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	1.56E+3	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Human thrombin and substrate were added to a 96-well assay plate containing inhibitor in reaction buffer. The rate of hydrolysis of the substrate was...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Coagulation factor VII (Homo sapiens (Human))	BDBM14601 (CHEMBL125585 | N-[(4-carbamimidoylphenyl)methyl]-2...) Show SMILES CC(C)Nc1ccc(-c2ccccc2)c(CC(=O)NCc2ccc(cc2)C(N)=N)c1O Show InChI InChI=1S/C25H28N4O2/c1-16(2)29-22-13-12-20(18-6-4-3-5-7-18)21(24(22)31)14-23(30)28-15-17-8-10-19(11-9-17)25(26)27/h3-13,16,29,31H,14-15H2,1-2H3,(H3,26,27)(H,28,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Recombinant human Factor VIIa and soluble tissue factor were added to a 96-well assay plate containing substrate and inhibitor in reaction buffer. Th...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Coagulation factor VII (Homo sapiens (Human))	BDBM14600 (N-[(4-carbamimidoylphenyl)methyl]-2-{2-hydroxy-6-p...) Show SMILES NC(=N)c1ccc(CNC(=O)Cc2c(O)c(NCCc3ccccc3)ccc2-c2ccccc2)cc1 Show InChI InChI=1S/C30H30N4O2/c31-30(32)24-13-11-22(12-14-24)20-34-28(35)19-26-25(23-9-5-2-6-10-23)15-16-27(29(26)36)33-18-17-21-7-3-1-4-8-21/h1-16,33,36H,17-20H2,(H3,31,32)(H,34,35)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.70E+3	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Recombinant human Factor VIIa and soluble tissue factor were added to a 96-well assay plate containing substrate and inhibitor in reaction buffer. Th...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Coagulation factor VII (Homo sapiens (Human))	BDBM14602 (Benzoquinone Analog 54 | N-[(4-carbamimidoylphenyl...) Show SMILES [#6]\[#6](-[#6])=[#7]\c1cc(-[#8])c(-c2ccccc2)c(-[#6]-[#6](=O)-[#7]-[#6]-c2ccc(cc2)-[#6](-[#7])=[#7])c1-[#8] Show InChI InChI=1S/C25H26N4O3/c1-15(2)29-20-13-21(30)23(17-6-4-3-5-7-17)19(24(20)32)12-22(31)28-14-16-8-10-18(11-9-16)25(26)27/h3-11,13,30,32H,12,14H2,1-2H3,(H3,26,27)(H,28,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.80E+3	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Recombinant human Factor VIIa and soluble tissue factor were added to a 96-well assay plate containing substrate and inhibitor in reaction buffer. Th...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Coagulation factor VII (Homo sapiens (Human))	BDBM14595 (N-[(4-carbamimidoylphenyl)methyl]-2-{2-fluoro-6-ph...) Show SMILES NC(=N)c1ccc(CNC(=O)Cc2c(F)c(NCCc3ccccc3)ccc2-c2ccccc2)cc1 Show InChI InChI=1S/C30H29FN4O/c31-29-26(19-28(36)35-20-22-11-13-24(14-12-22)30(32)33)25(23-9-5-2-6-10-23)15-16-27(29)34-18-17-21-7-3-1-4-8-21/h1-16,34H,17-20H2,(H3,32,33)(H,35,36)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.98E+3	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Recombinant human Factor VIIa and soluble tissue factor were added to a 96-well assay plate containing substrate and inhibitor in reaction buffer. Th...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM14600 (N-[(4-carbamimidoylphenyl)methyl]-2-{2-hydroxy-6-p...) Show SMILES NC(=N)c1ccc(CNC(=O)Cc2c(O)c(NCCc3ccccc3)ccc2-c2ccccc2)cc1 Show InChI InChI=1S/C30H30N4O2/c31-30(32)24-13-11-22(12-14-24)20-34-28(35)19-26-25(23-9-5-2-6-10-23)15-16-27(29(26)36)33-18-17-21-7-3-1-4-8-21/h1-16,33,36H,17-20H2,(H3,31,32)(H,34,35)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.80E+3	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Human thrombin and substrate were added to a 96-well assay plate containing inhibitor in reaction buffer. The rate of hydrolysis of the substrate was...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM14595 (N-[(4-carbamimidoylphenyl)methyl]-2-{2-fluoro-6-ph...) Show SMILES NC(=N)c1ccc(CNC(=O)Cc2c(F)c(NCCc3ccccc3)ccc2-c2ccccc2)cc1 Show InChI InChI=1S/C30H29FN4O/c31-29-26(19-28(36)35-20-22-11-13-24(14-12-22)30(32)33)25(23-9-5-2-6-10-23)15-16-27(29)34-18-17-21-7-3-1-4-8-21/h1-16,34H,17-20H2,(H3,32,33)(H,35,36)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	7.00E+3	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Human thrombin and substrate were added to a 96-well assay plate containing inhibitor in reaction buffer. The rate of hydrolysis of the substrate was...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM14599 (CHEMBL333980 | N-[(4-carbamimidoylphenyl)methyl]-2...) Show SMILES COc1c(NC(C)C)ccc(-c2ccccc2)c1CC(=O)NCc1ccc(cc1)C(N)=N Show InChI InChI=1S/C26H30N4O2/c1-17(2)30-23-14-13-21(19-7-5-4-6-8-19)22(25(23)32-3)15-24(31)29-16-18-9-11-20(12-10-18)26(27)28/h4-14,17,30H,15-16H2,1-3H3,(H3,27,28)(H,29,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	7.90E+3	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Human thrombin and substrate were added to a 96-well assay plate containing inhibitor in reaction buffer. The rate of hydrolysis of the substrate was...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM14598 (N-[(4-carbamimidoylphenyl)methyl]-2-{2-methoxy-6-p...) Show SMILES COc1c(NCCc2ccccc2)ccc(c1CC(=O)NCc1ccc(cc1)C(N)=N)-c1ccccc1 Show InChI InChI=1S/C31H32N4O2/c1-37-30-27(20-29(36)35-21-23-12-14-25(15-13-23)31(32)33)26(24-10-6-3-7-11-24)16-17-28(30)34-19-18-22-8-4-2-5-9-22/h2-17,34H,18-21H2,1H3,(H3,32,33)(H,35,36)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	9.50E+3	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Human thrombin and substrate were added to a 96-well assay plate containing inhibitor in reaction buffer. The rate of hydrolysis of the substrate was...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM14596 (2-[3-Amino-4-(benzylamino)-3-fluoro-1,1-biphenyl-2...) Show SMILES NC(=N)c1ccc(CNC(=O)Cc2c(F)c(NCc3ccccc3)ccc2-c2cccc(N)c2)cc1 Show InChI InChI=1S/C29H28FN5O/c30-28-25(16-27(36)35-18-20-9-11-21(12-10-20)29(32)33)24(22-7-4-8-23(31)15-22)13-14-26(28)34-17-19-5-2-1-3-6-19/h1-15,34H,16-18,31H2,(H3,32,33)(H,35,36)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Human thrombin and substrate were added to a 96-well assay plate containing inhibitor in reaction buffer. The rate of hydrolysis of the substrate was...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Coagulation factor VII (Homo sapiens (Human))	BDBM14599 (CHEMBL333980 | N-[(4-carbamimidoylphenyl)methyl]-2...) Show SMILES COc1c(NC(C)C)ccc(-c2ccccc2)c1CC(=O)NCc1ccc(cc1)C(N)=N Show InChI InChI=1S/C26H30N4O2/c1-17(2)30-23-14-13-21(19-7-5-4-6-8-19)22(25(23)32-3)15-24(31)29-16-18-9-11-20(12-10-18)26(27)28/h4-14,17,30H,15-16H2,1-3H3,(H3,27,28)(H,29,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.47E+4	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Recombinant human Factor VIIa and soluble tissue factor were added to a 96-well assay plate containing substrate and inhibitor in reaction buffer. Th...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Coagulation factor VII (Homo sapiens (Human))	BDBM14594 (N-[(4-carbamimidoylphenyl)methyl]-2-{2,6-difluoro-...) Show SMILES NC(=N)c1ccc(CNC(=O)Cc2c(F)ccc(NCCc3ccccc3)c2F)cc1 Show InChI InChI=1S/C24H24F2N4O/c25-20-10-11-21(29-13-12-16-4-2-1-3-5-16)23(26)19(20)14-22(31)30-15-17-6-8-18(9-7-17)24(27)28/h1-11,29H,12-15H2,(H3,27,28)(H,30,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	1.64E+4	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Recombinant human Factor VIIa and soluble tissue factor were added to a 96-well assay plate containing substrate and inhibitor in reaction buffer. Th...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Coagulation factor VII (Homo sapiens (Human))	BDBM14598 (N-[(4-carbamimidoylphenyl)methyl]-2-{2-methoxy-6-p...) Show SMILES COc1c(NCCc2ccccc2)ccc(c1CC(=O)NCc1ccc(cc1)C(N)=N)-c1ccccc1 Show InChI InChI=1S/C31H32N4O2/c1-37-30-27(20-29(36)35-21-23-12-14-25(15-13-23)31(32)33)26(24-10-6-3-7-11-24)16-17-28(30)34-19-18-22-8-4-2-5-9-22/h2-17,34H,18-21H2,1H3,(H3,32,33)(H,35,36)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.50E+4	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Recombinant human Factor VIIa and soluble tissue factor were added to a 96-well assay plate containing substrate and inhibitor in reaction buffer. Th...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM14603 (N-[(4-carbamimidoylphenyl)methyl]-2-[2,6-difluoro-...) Show SMILES NC(=N)c1ccc(CNC(=O)Cc2c(F)ccc(NS(=O)(=O)Cc3ccccc3)c2F)cc1 Show InChI InChI=1S/C23H22F2N4O3S/c24-19-10-11-20(29-33(31,32)14-16-4-2-1-3-5-16)22(25)18(19)12-21(30)28-13-15-6-8-17(9-7-15)23(26)27/h1-11,29H,12-14H2,(H3,26,27)(H,28,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	2.69E+4	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Human thrombin and substrate were added to a 96-well assay plate containing inhibitor in reaction buffer. The rate of hydrolysis of the substrate was...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM14598 (N-[(4-carbamimidoylphenyl)methyl]-2-{2-methoxy-6-p...) Show SMILES COc1c(NCCc2ccccc2)ccc(c1CC(=O)NCc1ccc(cc1)C(N)=N)-c1ccccc1 Show InChI InChI=1S/C31H32N4O2/c1-37-30-27(20-29(36)35-21-23-12-14-25(15-13-23)31(32)33)26(24-10-6-3-7-11-24)16-17-28(30)34-19-18-22-8-4-2-5-9-22/h2-17,34H,18-21H2,1H3,(H3,32,33)(H,35,36)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Human Factor Xa and substrate were added to a 96-well assay plate containing inhibitor in reaction buffer. The rate of hydrolysis of the substrate wa...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM14599 (CHEMBL333980 | N-[(4-carbamimidoylphenyl)methyl]-2...) Show SMILES COc1c(NC(C)C)ccc(-c2ccccc2)c1CC(=O)NCc1ccc(cc1)C(N)=N Show InChI InChI=1S/C26H30N4O2/c1-17(2)30-23-14-13-21(19-7-5-4-6-8-19)22(25(23)32-3)15-24(31)29-16-18-9-11-20(12-10-18)26(27)28/h4-14,17,30H,15-16H2,1-3H3,(H3,27,28)(H,29,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Human Factor Xa and substrate were added to a 96-well assay plate containing inhibitor in reaction buffer. The rate of hydrolysis of the substrate wa...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM14600 (N-[(4-carbamimidoylphenyl)methyl]-2-{2-hydroxy-6-p...) Show SMILES NC(=N)c1ccc(CNC(=O)Cc2c(O)c(NCCc3ccccc3)ccc2-c2ccccc2)cc1 Show InChI InChI=1S/C30H30N4O2/c31-30(32)24-13-11-22(12-14-24)20-34-28(35)19-26-25(23-9-5-2-6-10-23)15-16-27(29(26)36)33-18-17-21-7-3-1-4-8-21/h1-16,33,36H,17-20H2,(H3,31,32)(H,34,35)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Human Factor Xa and substrate were added to a 96-well assay plate containing inhibitor in reaction buffer. The rate of hydrolysis of the substrate wa...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM14601 (CHEMBL125585 | N-[(4-carbamimidoylphenyl)methyl]-2...) Show SMILES CC(C)Nc1ccc(-c2ccccc2)c(CC(=O)NCc2ccc(cc2)C(N)=N)c1O Show InChI InChI=1S/C25H28N4O2/c1-16(2)29-22-13-12-20(18-6-4-3-5-7-18)21(24(22)31)14-23(30)28-15-17-8-10-19(11-9-17)25(26)27/h3-13,16,29,31H,14-15H2,1-2H3,(H3,26,27)(H,28,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Human Factor Xa and substrate were added to a 96-well assay plate containing inhibitor in reaction buffer. The rate of hydrolysis of the substrate wa...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM14602 (Benzoquinone Analog 54 | N-[(4-carbamimidoylphenyl...) Show SMILES [#6]\[#6](-[#6])=[#7]\c1cc(-[#8])c(-c2ccccc2)c(-[#6]-[#6](=O)-[#7]-[#6]-c2ccc(cc2)-[#6](-[#7])=[#7])c1-[#8] Show InChI InChI=1S/C25H26N4O3/c1-15(2)29-20-13-21(30)23(17-6-4-3-5-7-17)19(24(20)32)12-22(31)28-14-16-8-10-18(11-9-16)25(26)27/h3-11,13,30,32H,12,14H2,1-2H3,(H3,26,27)(H,28,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Human Factor Xa and substrate were added to a 96-well assay plate containing inhibitor in reaction buffer. The rate of hydrolysis of the substrate wa...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM14603 (N-[(4-carbamimidoylphenyl)methyl]-2-[2,6-difluoro-...) Show SMILES NC(=N)c1ccc(CNC(=O)Cc2c(F)ccc(NS(=O)(=O)Cc3ccccc3)c2F)cc1 Show InChI InChI=1S/C23H22F2N4O3S/c24-19-10-11-20(29-33(31,32)14-16-4-2-1-3-5-16)22(25)18(19)12-21(30)28-13-15-6-8-17(9-7-15)23(26)27/h1-11,29H,12-14H2,(H3,26,27)(H,28,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Human Factor Xa and substrate were added to a 96-well assay plate containing inhibitor in reaction buffer. The rate of hydrolysis of the substrate wa...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM14597 (2-[3-Amino-3-fluoro-4-(isopropylamino)-1,1-bipheny...) Show SMILES CC(C)Nc1ccc(-c2cccc(N)c2)c(CC(=O)NCc2ccc(cc2)C(N)=N)c1F Show InChI InChI=1S/C25H28FN5O/c1-15(2)31-22-11-10-20(18-4-3-5-19(27)12-18)21(24(22)26)13-23(32)30-14-16-6-8-17(9-7-16)25(28)29/h3-12,15,31H,13-14,27H2,1-2H3,(H3,28,29)(H,30,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Human Factor Xa and substrate were added to a 96-well assay plate containing inhibitor in reaction buffer. The rate of hydrolysis of the substrate wa...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM14595 (N-[(4-carbamimidoylphenyl)methyl]-2-{2-fluoro-6-ph...) Show SMILES NC(=N)c1ccc(CNC(=O)Cc2c(F)c(NCCc3ccccc3)ccc2-c2ccccc2)cc1 Show InChI InChI=1S/C30H29FN4O/c31-29-26(19-28(36)35-20-22-11-13-24(14-12-22)30(32)33)25(23-9-5-2-6-10-23)15-16-27(29)34-18-17-21-7-3-1-4-8-21/h1-16,34H,17-20H2,(H3,32,33)(H,35,36)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Human Factor Xa and substrate were added to a 96-well assay plate containing inhibitor in reaction buffer. The rate of hydrolysis of the substrate wa...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM14594 (N-[(4-carbamimidoylphenyl)methyl]-2-{2,6-difluoro-...) Show SMILES NC(=N)c1ccc(CNC(=O)Cc2c(F)ccc(NCCc3ccccc3)c2F)cc1 Show InChI InChI=1S/C24H24F2N4O/c25-20-10-11-21(29-13-12-16-4-2-1-3-5-16)23(26)19(20)14-22(31)30-15-17-6-8-18(9-7-17)24(27)28/h1-11,29H,12-15H2,(H3,27,28)(H,30,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Human Factor Xa and substrate were added to a 96-well assay plate containing inhibitor in reaction buffer. The rate of hydrolysis of the substrate wa...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM14602 (Benzoquinone Analog 54 | N-[(4-carbamimidoylphenyl...) Show SMILES [#6]\[#6](-[#6])=[#7]\c1cc(-[#8])c(-c2ccccc2)c(-[#6]-[#6](=O)-[#7]-[#6]-c2ccc(cc2)-[#6](-[#7])=[#7])c1-[#8] Show InChI InChI=1S/C25H26N4O3/c1-15(2)29-20-13-21(30)23(17-6-4-3-5-7-17)19(24(20)32)12-22(31)28-14-16-8-10-18(11-9-16)25(26)27/h3-11,13,30,32H,12,14H2,1-2H3,(H3,26,27)(H,28,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Human thrombin and substrate were added to a 96-well assay plate containing inhibitor in reaction buffer. The rate of hydrolysis of the substrate was...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM14601 (CHEMBL125585 | N-[(4-carbamimidoylphenyl)methyl]-2...) Show SMILES CC(C)Nc1ccc(-c2ccccc2)c(CC(=O)NCc2ccc(cc2)C(N)=N)c1O Show InChI InChI=1S/C25H28N4O2/c1-16(2)29-22-13-12-20(18-6-4-3-5-7-18)21(24(22)31)14-23(30)28-15-17-8-10-19(11-9-17)25(26)27/h3-13,16,29,31H,14-15H2,1-2H3,(H3,26,27)(H,28,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Human thrombin and substrate were added to a 96-well assay plate containing inhibitor in reaction buffer. The rate of hydrolysis of the substrate was...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Coagulation factor VII (Homo sapiens (Human))	BDBM14603 (N-[(4-carbamimidoylphenyl)methyl]-2-[2,6-difluoro-...) Show SMILES NC(=N)c1ccc(CNC(=O)Cc2c(F)ccc(NS(=O)(=O)Cc3ccccc3)c2F)cc1 Show InChI InChI=1S/C23H22F2N4O3S/c24-19-10-11-20(29-33(31,32)14-16-4-2-1-3-5-16)22(25)18(19)12-21(30)28-13-15-6-8-17(9-7-15)23(26)27/h1-11,29H,12-14H2,(H3,26,27)(H,28,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Recombinant human Factor VIIa and soluble tissue factor were added to a 96-well assay plate containing substrate and inhibitor in reaction buffer. Th...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM14596 (2-[3-Amino-4-(benzylamino)-3-fluoro-1,1-biphenyl-2...) Show SMILES NC(=N)c1ccc(CNC(=O)Cc2c(F)c(NCc3ccccc3)ccc2-c2cccc(N)c2)cc1 Show InChI InChI=1S/C29H28FN5O/c30-28-25(16-27(36)35-18-20-9-11-21(12-10-20)29(32)33)24(22-7-4-8-23(31)15-22)13-14-26(28)34-17-19-5-2-1-3-6-19/h1-15,34H,16-18,31H2,(H3,32,33)(H,35,36)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	8.0	22
Pharmacia Corporation					Assay Description Human Factor Xa and substrate were added to a 96-well assay plate containing inhibitor in reaction buffer. The rate of hydrolysis of the substrate wa...				J Med Chem 46: 4297-312 (2003) Article DOI: 10.1021/jm030233b BindingDB Entry DOI: 10.7270/Q2B27SJR
					More data for this Ligand-Target Pair