Compile Data Set for Download or QSAR

Found 109 hits Enz. Inhib. hit(s) with all data for entry = 50041087   

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 (Bos taurus (Bovine))	BDBM50404562 (CHEMBL353809) Show SMILES CCC1CCN(CC1)C(=O)C(CCCNC(N)=N)NS(=O)(=O)c1ccc2Oc3ccccc3Oc2c1 Show InChI InChI=1S/C25H33N5O5S/c1-2-17-11-14-30(15-12-17)24(31)19(6-5-13-28-25(26)27)29-36(32,33)18-9-10-22-23(16-18)35-21-8-4-3-7-20(21)34-22/h3-4,7-10,16-17,19,29H,2,5-6,11-15H2,1H3,(H4,26,27,28)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404544 (CHEMBL355327) Show SMILES CCC1CCN(CC1)C(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2c3ccccc3oc12 Show InChI InChI=1S/C25H33N5O4S/c1-2-17-12-15-30(16-13-17)24(31)20(9-6-14-28-25(26)27)29-35(32,33)22-11-5-8-19-18-7-3-4-10-21(18)34-23(19)22/h3-5,7-8,10-11,17,20,29H,2,6,9,12-16H2,1H3,(H4,26,27,28)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404567 (CHEMBL168621) Show SMILES CCC1CCN(CC1)C(=O)C(CCCNC(N)=N)NS(=O)(=O)c1ccc2c(c1)oc1ccccc21 Show InChI InChI=1S/C25H33N5O4S/c1-2-17-11-14-30(15-12-17)24(31)21(7-5-13-28-25(26)27)29-35(32,33)18-9-10-20-19-6-3-4-8-22(19)34-23(20)16-18/h3-4,6,8-10,16-17,21,29H,2,5,7,11-15H2,1H3,(H4,26,27,28)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404563 (CHEMBL352975) Show SMILES CCC1CCN(CC1)C(=O)C(CCCNC(N)=N)NS(=O)(=O)c1ccc2Oc3ccccc3Cc2c1 Show InChI InChI=1S/C26H35N5O4S/c1-2-18-11-14-31(15-12-18)25(32)22(7-5-13-29-26(27)28)30-36(33,34)21-9-10-24-20(17-21)16-19-6-3-4-8-23(19)35-24/h3-4,6,8-10,17-18,22,30H,2,5,7,11-16H2,1H3,(H4,27,28,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404623 (CHEMBL168547) Show SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)NC(CCCNC(N)=N)C(=O)N1Cc2ccccc2C1 Show InChI InChI=1S/C26H32N6O3S/c1-31(2)23-13-5-11-21-20(23)10-6-14-24(21)36(34,35)30-22(12-7-15-29-26(27)28)25(33)32-16-18-8-3-4-9-19(18)17-32/h3-6,8-11,13-14,22,30H,7,12,15-17H2,1-2H3,(H4,27,28,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	670	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404564 (CHEMBL353701) Show SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)NC(CCCNC(N)=N)C(=O)N1CCc2ccccc12 Show InChI InChI=1S/C26H32N6O3S/c1-31(2)23-13-5-10-20-19(23)9-6-14-24(20)36(34,35)30-21(11-7-16-29-26(27)28)25(33)32-17-15-18-8-3-4-12-22(18)32/h3-6,8-10,12-14,21,30H,7,11,15-17H2,1-2H3,(H4,27,28,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404632 (CHEMBL169627) Show SMILES CCCCNC(=O)C(CCCNC(N)=N)NS(=O)(=O)c1ccc2CCCCc2c1 Show InChI InChI=1S/C20H33N5O3S/c1-2-3-12-23-19(26)18(9-6-13-24-20(21)22)25-29(27,28)17-11-10-15-7-4-5-8-16(15)14-17/h10-11,14,18,25H,2-9,12-13H2,1H3,(H,23,26)(H4,21,22,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404597 (CHEMBL169106) Show SMILES CCC1CCN(CC1)C(=O)C(CCCNC(N)=N)NS(=O)(=O)c1ccc2OCCCOc2c1 Show InChI InChI=1S/C22H35N5O5S/c1-2-16-8-11-27(12-9-16)21(28)18(5-3-10-25-22(23)24)26-33(29,30)17-6-7-19-20(15-17)32-14-4-13-31-19/h6-7,15-16,18,26H,2-5,8-14H2,1H3,(H4,23,24,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404550 (CHEMBL169306) Show SMILES NC(=N)NCCCC(NS(=O)(=O)c1cccc2CCCCc12)C(=O)N1CCOCC1 Show InChI InChI=1S/C20H31N5O4S/c21-20(22)23-10-4-8-17(19(26)25-11-13-29-14-12-25)24-30(27,28)18-9-3-6-15-5-1-2-7-16(15)18/h3,6,9,17,24H,1-2,4-5,7-8,10-14H2,(H4,21,22,23)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	6.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404566 (CHEMBL168677) Show SMILES CC1CCN(CC1)C(=O)C(CCCNC(N)=N)NS(=O)(=O)c1ccc2OCCCOc2c1 Show InChI InChI=1S/C21H33N5O5S/c1-15-7-10-26(11-8-15)20(27)17(4-2-9-24-21(22)23)25-32(28,29)16-5-6-18-19(14-16)31-13-3-12-30-18/h5-6,14-15,17,25H,2-4,7-13H2,1H3,(H4,22,23,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404583 (CHEMBL167162) Show SMILES CCC1CCN(CC1)C(=O)C(CCCNC(N)=N)NS(=O)(=O)c1ccc2cc3OCCOc3cc2c1 Show InChI InChI=1S/C25H35N5O5S/c1-2-17-7-10-30(11-8-17)24(31)21(4-3-9-28-25(26)27)29-36(32,33)20-6-5-18-15-22-23(16-19(18)14-20)35-13-12-34-22/h5-6,14-17,21,29H,2-4,7-13H2,1H3,(H4,26,27,28)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404584 (CHEMBL169775) Show SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)NC(CCCNC(N)=N)C(=O)N1CCCc2ccccc12 Show InChI InChI=1S/C27H34N6O3S/c1-32(2)24-15-5-12-21-20(24)11-6-16-25(21)37(35,36)31-22(13-7-17-30-27(28)29)26(34)33-18-8-10-19-9-3-4-14-23(19)33/h3-6,9,11-12,14-16,22,31H,7-8,10,13,17-18H2,1-2H3,(H4,28,29,30)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404537 (CHEMBL169419) Show SMILES CCC1CCN(CC1)C(=O)C(CCCNC(N)=N)NS(=O)(=O)c1ccc2OCCOc2c1 Show InChI InChI=1S/C21H33N5O5S/c1-2-15-7-10-26(11-8-15)20(27)17(4-3-9-24-21(22)23)25-32(28,29)16-5-6-18-19(14-16)31-13-12-30-18/h5-6,14-15,17,25H,2-4,7-13H2,1H3,(H4,22,23,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404546 (CHEMBL166914) Show SMILES COCCNC(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2CCCCc12 Show InChI InChI=1S/C19H31N5O4S/c1-28-13-12-22-18(25)16(9-5-11-23-19(20)21)24-29(26,27)17-10-4-7-14-6-2-3-8-15(14)17/h4,7,10,16,24H,2-3,5-6,8-9,11-13H2,1H3,(H,22,25)(H4,20,21,23)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404631 (CHEMBL422205) Show SMILES CCCCNC(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2ccccc12 Show InChI InChI=1S/C20H29N5O3S/c1-2-3-13-23-19(26)17(11-7-14-24-20(21)22)25-29(27,28)18-12-6-9-15-8-4-5-10-16(15)18/h4-6,8-10,12,17,25H,2-3,7,11,13-14H2,1H3,(H,23,26)(H4,21,22,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404619 (CHEMBL352546) Show SMILES COc1ccc(CNC(=O)C(CCCNC(N)=N)NS(=O)(=O)c2cccc3c(cccc23)N(C)C)cc1 Show InChI InChI=1S/C26H34N6O4S/c1-32(2)23-10-4-8-21-20(23)7-5-11-24(21)37(34,35)31-22(9-6-16-29-26(27)28)25(33)30-17-18-12-14-19(36-3)15-13-18/h4-5,7-8,10-15,22,31H,6,9,16-17H2,1-3H3,(H,30,33)(H4,27,28,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404605 (CHEMBL168401) Show SMILES CCC1CCN(CC1)C(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2c(cccc12)N(C)C Show InChI InChI=1S/C25H38N6O3S/c1-4-18-13-16-31(17-14-18)24(32)21(10-7-15-28-25(26)27)29-35(33,34)23-12-6-8-19-20(23)9-5-11-22(19)30(2)3/h5-6,8-9,11-12,18,21,29H,4,7,10,13-17H2,1-3H3,(H4,26,27,28)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50102210 (5-Dimethylamino-naphthalene-1-sulfonic acid [4-gua...) Show SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)NC(CCCNC(N)=N)C(=O)N1CCCCC1 Show InChI InChI=1S/C23H34N6O3S/c1-28(2)20-12-6-10-18-17(20)9-7-13-21(18)33(31,32)27-19(11-8-14-26-23(24)25)22(30)29-15-4-3-5-16-29/h6-7,9-10,12-13,19,27H,3-5,8,11,14-16H2,1-2H3,(H4,24,25,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404612 (CHEMBL352359) Show SMILES CCOc1cccc2c(cccc12)S(=O)(=O)NC(CCCNC(N)=N)C(=O)N1CCC(CC)CC1 Show InChI InChI=1S/C25H37N5O4S/c1-3-18-13-16-30(17-14-18)24(31)21(10-7-15-28-25(26)27)29-35(32,33)23-12-6-8-19-20(23)9-5-11-22(19)34-4-2/h5-6,8-9,11-12,18,21,29H,3-4,7,10,13-17H2,1-2H3,(H4,26,27,28)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404622 (CHEMBL354563) Show SMILES CC(C)CNC(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2c(cccc12)N(C)C Show InChI InChI=1S/C22H34N6O3S/c1-15(2)14-26-21(29)18(10-7-13-25-22(23)24)27-32(30,31)20-12-6-8-16-17(20)9-5-11-19(16)28(3)4/h5-6,8-9,11-12,15,18,27H,7,10,13-14H2,1-4H3,(H,26,29)(H4,23,24,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404625 (CHEMBL355417) Show SMILES CCC1CCN(CC1)C(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2ccccc12 Show InChI InChI=1S/C23H33N5O3S/c1-2-17-12-15-28(16-13-17)22(29)20(10-6-14-26-23(24)25)27-32(30,31)21-11-5-8-18-7-3-4-9-19(18)21/h3-5,7-9,11,17,20,27H,2,6,10,12-16H2,1H3,(H4,24,25,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404603 (CHEMBL168879) Show SMILES CCC1CCN(CC1)C(=O)C(CCCNC(N)=N)NS(=O)(=O)c1ccc2ccccc2c1 Show InChI InChI=1S/C23H33N5O3S/c1-2-17-11-14-28(15-12-17)22(29)21(8-5-13-26-23(24)25)27-32(30,31)20-10-9-18-6-3-4-7-19(18)16-20/h3-4,6-7,9-10,16-17,21,27H,2,5,8,11-15H2,1H3,(H4,24,25,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404602 (CHEMBL352851) Show SMILES CCC1CCN(CC1)C(=O)C(CCC[N-]C(N)=[NH2+])NS(=O)(=O)c1cccc2c(cccc12)[N+]([O-])=O Show InChI InChI=1S/C23H31N6O5S/c1-2-16-11-14-28(15-12-16)22(30)19(8-5-13-26-23(24)25)27-35(33,34)21-10-4-6-17-18(21)7-3-9-20(17)29(31)32/h3-4,6-7,9-10,16,19,27H,2,5,8,11-15H2,1H3,(H3-,24,25,26)/q-1/p+1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404600 (CHEMBL350603) Show SMILES CCC1CCN(CC1)C(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cc(OC)c2cc(OC)ccc2c1 Show InChI InChI=1S/C25H37N5O5S/c1-4-17-9-12-30(13-10-17)24(31)22(6-5-11-28-25(26)27)29-36(32,33)20-14-18-7-8-19(34-2)15-21(18)23(16-20)35-3/h7-8,14-17,22,29H,4-6,9-13H2,1-3H3,(H4,26,27,28)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404594 (CHEMBL354149) Show SMILES NC(=N)NCCCC(NS(=O)(=O)c1cccc2ccccc12)C(=O)N1CCCCCC1 Show InChI InChI=1S/C22H31N5O3S/c23-22(24)25-14-8-12-19(21(28)27-15-5-1-2-6-16-27)26-31(29,30)20-13-7-10-17-9-3-4-11-18(17)20/h3-4,7,9-11,13,19,26H,1-2,5-6,8,12,14-16H2,(H4,23,24,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404593 (CHEMBL433916) Show SMILES CC1CCN(CC1)C(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2CCCCc12 Show InChI InChI=1S/C22H35N5O3S/c1-16-11-14-27(15-12-16)21(28)19(9-5-13-25-22(23)24)26-31(29,30)20-10-4-7-17-6-2-3-8-18(17)20/h4,7,10,16,19,26H,2-3,5-6,8-9,11-15H2,1H3,(H4,23,24,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404590 (CHEMBL167637) Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)NC(CCCNC(N)=N)C(=O)N1CCC(C)CC1 Show InChI InChI=1S/C23H33N5O4S/c1-16-9-12-28(13-10-16)22(29)21(4-3-11-26-23(24)25)27-33(30,31)20-8-6-17-5-7-19(32-2)14-18(17)15-20/h5-8,14-16,21,27H,3-4,9-13H2,1-2H3,(H4,24,25,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404587 (CHEMBL355110) Show SMILES CCC1CCN(CC1)C(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2c(cccc12)C(O)=O Show InChI InChI=1S/C24H33N5O5S/c1-2-16-11-14-29(15-12-16)22(30)20(9-5-13-27-24(25)26)28-35(33,34)21-10-4-6-17-18(21)7-3-8-19(17)23(31)32/h3-4,6-8,10,16,20,28H,2,5,9,11-15H2,1H3,(H,31,32)(H4,25,26,27)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404586 (CHEMBL169487) Show SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)NC(CCCNC(N)=N)C(=O)N1CCCCCCC1 Show InChI InChI=1S/C25H38N6O3S/c1-30(2)22-14-8-12-20-19(22)11-9-15-23(20)35(33,34)29-21(13-10-16-28-25(26)27)24(32)31-17-6-4-3-5-7-18-31/h8-9,11-12,14-15,21,29H,3-7,10,13,16-18H2,1-2H3,(H4,26,27,28)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404580 (CHEMBL166882) Show SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)NC(CCCNC(N)=N)C(=O)NCC=C Show InChI InChI=1S/C21H30N6O3S/c1-4-13-24-20(28)17(10-7-14-25-21(22)23)26-31(29,30)19-12-6-8-15-16(19)9-5-11-18(15)27(2)3/h4-6,8-9,11-12,17,26H,1,7,10,13-14H2,2-3H3,(H,24,28)(H4,22,23,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404577 (CHEMBL353636) Show SMILES CCC1CCN(CC1)C(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cc(OC)c2ccccc2c1 Show InChI InChI=1S/C24H35N5O4S/c1-3-17-10-13-29(14-11-17)23(30)21(9-6-12-27-24(25)26)28-34(31,32)19-15-18-7-4-5-8-20(18)22(16-19)33-2/h4-5,7-8,15-17,21,28H,3,6,9-14H2,1-2H3,(H4,25,26,27)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404570 (CHEMBL168905) Show SMILES CCCC1CCN(CC1)C(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2c(cccc12)N(C)C Show InChI InChI=1S/C26H40N6O3S/c1-4-8-19-14-17-32(18-15-19)25(33)22(11-7-16-29-26(27)28)30-36(34,35)24-13-6-9-20-21(24)10-5-12-23(20)31(2)3/h5-6,9-10,12-13,19,22,30H,4,7-8,11,14-18H2,1-3H3,(H4,27,28,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404568 (CHEMBL354977) Show SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)NC(CCCNC(N)=N)C(=O)N1CC2CCCC(C2)C1 Show InChI InChI=1S/C26H38N6O3S/c1-31(2)23-12-4-10-21-20(23)9-5-13-24(21)36(34,35)30-22(11-6-14-29-26(27)28)25(33)32-16-18-7-3-8-19(15-18)17-32/h4-5,9-10,12-13,18-19,22,30H,3,6-8,11,14-17H2,1-2H3,(H4,27,28,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404561 (CHEMBL168594) Show SMILES CCCCCCCNC(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2c(cccc12)N(C)C Show InChI InChI=1S/C25H40N6O3S/c1-4-5-6-7-8-17-28-24(32)21(14-11-18-29-25(26)27)30-35(33,34)23-16-10-12-19-20(23)13-9-15-22(19)31(2)3/h9-10,12-13,15-16,21,30H,4-8,11,14,17-18H2,1-3H3,(H,28,32)(H4,26,27,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404545 (CHEMBL352789) Show SMILES NC(=N)NCCCC(NS(=O)(=O)c1cccc2ccccc12)C(=O)N1CCC(CC1)c1ccccc1 Show InChI InChI=1S/C27H33N5O3S/c28-27(29)30-17-7-13-24(26(33)32-18-15-21(16-19-32)20-8-2-1-3-9-20)31-36(34,35)25-14-6-11-22-10-4-5-12-23(22)25/h1-6,8-12,14,21,24,31H,7,13,15-19H2,(H4,28,29,30)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404543 (CHEMBL354355) Show SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)NC(CCCNC(N)=N)C(=O)N1CCC(CC1)c1ccccc1 Show InChI InChI=1S/C29H38N6O3S/c1-34(2)26-14-6-12-24-23(26)11-7-15-27(24)39(37,38)33-25(13-8-18-32-29(30)31)28(36)35-19-16-22(17-20-35)21-9-4-3-5-10-21/h3-7,9-12,14-15,22,25,33H,8,13,16-20H2,1-2H3,(H4,30,31,32)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404637 (CHEMBL262275) Show SMILES CCC1CCN(CC1)C(=O)C(CCCNC(N)=N)NS(=O)(=O)c1ccc2oc(=O)c(CC)cc2c1 Show InChI InChI=1S/C24H35N5O5S/c1-3-16-9-12-29(13-10-16)22(30)20(6-5-11-27-24(25)26)28-35(32,33)19-7-8-21-18(15-19)14-17(4-2)23(31)34-21/h7-8,14-16,20,28H,3-6,9-13H2,1-2H3,(H4,25,26,27)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	1.00E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404542 (CHEMBL166858) Show SMILES CCC1CCN(CC1)C(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2ccc(C)cc12 Show InChI InChI=1S/C24H35N5O3S/c1-3-18-11-14-29(15-12-18)23(30)21(7-5-13-27-24(25)26)28-33(31,32)22-8-4-6-19-10-9-17(2)16-20(19)22/h4,6,8-10,16,18,21,28H,3,5,7,11-15H2,1-2H3,(H4,25,26,27)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404636 (CHEMBL352304) Show SMILES CCC1CCN(CC1)C(=O)C(CCCNC(N)=N)NS(=O)(=O)c1ccc2ccc(OC)cc2c1 Show InChI InChI=1S/C24H35N5O4S/c1-3-17-10-13-29(14-11-17)23(30)22(5-4-12-27-24(25)26)28-34(31,32)21-9-7-18-6-8-20(33-2)15-19(18)16-21/h6-9,15-17,22,28H,3-5,10-14H2,1-2H3,(H4,25,26,27)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404628 (CHEMBL353366) Show SMILES CCNC(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2c(cccc12)N(C)C Show InChI InChI=1S/C20H30N6O3S/c1-4-23-19(27)16(10-7-13-24-20(21)22)25-30(28,29)18-12-6-8-14-15(18)9-5-11-17(14)26(2)3/h5-6,8-9,11-12,16,25H,4,7,10,13H2,1-3H3,(H,23,27)(H4,21,22,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404627 (CHEMBL167349) Show SMILES CC(C)C1CCN(CC1)C(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2c(cccc12)N(C)C Show InChI InChI=1S/C26H40N6O3S/c1-18(2)19-13-16-32(17-14-19)25(33)22(10-7-15-29-26(27)28)30-36(34,35)24-12-6-8-20-21(24)9-5-11-23(20)31(3)4/h5-6,8-9,11-12,18-19,22,30H,7,10,13-17H2,1-4H3,(H4,27,28,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404569 (CHEMBL166585) Show SMILES CC(C)NC(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2c(cccc12)N(C)C Show InChI InChI=1S/C21H32N6O3S/c1-14(2)25-20(28)17(10-7-13-24-21(22)23)26-31(29,30)19-12-6-8-15-16(19)9-5-11-18(15)27(3)4/h5-6,8-9,11-12,14,17,26H,7,10,13H2,1-4H3,(H,25,28)(H4,22,23,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.10E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404574 (CHEMBL354654) Show SMILES CCCCCNC(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2c(cccc12)N(C)C Show InChI InChI=1S/C23H36N6O3S/c1-4-5-6-15-26-22(30)19(12-9-16-27-23(24)25)28-33(31,32)21-14-8-10-17-18(21)11-7-13-20(17)29(2)3/h7-8,10-11,13-14,19,28H,4-6,9,12,15-16H2,1-3H3,(H,26,30)(H4,24,25,27)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.30E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404581 (CHEMBL165694) Show SMILES CC1CCCCN1C(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2c(cccc12)N(C)C Show InChI InChI=1S/C24H36N6O3S/c1-17-9-4-5-16-30(17)23(31)20(12-8-15-27-24(25)26)28-34(32,33)22-14-7-10-18-19(22)11-6-13-21(18)29(2)3/h6-7,10-11,13-14,17,20,28H,4-5,8-9,12,15-16H2,1-3H3,(H4,25,26,27)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.30E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404579 (CHEMBL168918) Show SMILES CCC1CCN(CC1)C(=O)C(CCCNC(N)=N)NS(=O)(=O)c1ccc2cc(OC)c(OC)cc2c1 Show InChI InChI=1S/C25H37N5O5S/c1-4-17-9-12-30(13-10-17)24(31)21(6-5-11-28-25(26)27)29-36(32,33)20-8-7-18-15-22(34-2)23(35-3)16-19(18)14-20/h7-8,14-17,21,29H,4-6,9-13H2,1-3H3,(H4,26,27,28)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.50E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404585 (CHEMBL170611) Show SMILES CCC1CCN(CC1)C(=O)C(CCCNC(N)=N)NS(=O)(=O)c1ccc2C(=O)c3ccccc3C(=O)c2c1 Show InChI InChI=1S/C27H33N5O5S/c1-2-17-11-14-32(15-12-17)26(35)23(8-5-13-30-27(28)29)31-38(36,37)18-9-10-21-22(16-18)25(34)20-7-4-3-6-19(20)24(21)33/h3-4,6-7,9-10,16-17,23,31H,2,5,8,11-15H2,1H3,(H4,28,29,30)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.50E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404592 (CHEMBL352882) Show SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)NC(CCCNC(N)=N)C(=O)NCCc1ccccc1 Show InChI InChI=1S/C26H34N6O3S/c1-32(2)23-14-6-12-21-20(23)11-7-15-24(21)36(34,35)31-22(13-8-17-30-26(27)28)25(33)29-18-16-19-9-4-3-5-10-19/h3-7,9-12,14-15,22,31H,8,13,16-18H2,1-2H3,(H,29,33)(H4,27,28,30)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.50E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404606 (CHEMBL423271) Show SMILES CCC1CCN(CC1)C(=O)C(CCCNC(N)=N)NS(=O)(=O)c1ccc2OCCCc2c1 Show InChI InChI=1S/C22H35N5O4S/c1-2-16-9-12-27(13-10-16)21(28)19(6-3-11-25-22(23)24)26-32(29,30)18-7-8-20-17(15-18)5-4-14-31-20/h7-8,15-16,19,26H,2-6,9-14H2,1H3,(H4,23,24,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.50E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404608 (CHEMBL354577) Show SMILES CCCNC(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2c(cccc12)N(C)C Show InChI InChI=1S/C21H32N6O3S/c1-4-13-24-20(28)17(10-7-14-25-21(22)23)26-31(29,30)19-12-6-8-15-16(19)9-5-11-18(15)27(2)3/h5-6,8-9,11-12,17,26H,4,7,10,13-14H2,1-3H3,(H,24,28)(H4,22,23,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.50E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404638 (CHEMBL168123) Show SMILES COc1cc2ccc(cc2cc1OC)S(=O)(=O)NC(CCCNC(N)=N)C(=O)N1CCC(C)CC1 Show InChI InChI=1S/C24H35N5O5S/c1-16-8-11-29(12-9-16)23(30)20(5-4-10-27-24(25)26)28-35(31,32)19-7-6-17-14-21(33-2)22(34-3)15-18(17)13-19/h6-7,13-16,20,28H,4-5,8-12H2,1-3H3,(H4,25,26,27)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.50E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bovine thrombin concentration at which clotting time was prolonged 2x over the control.				J Med Chem 23: 830-6 (1980) BindingDB Entry DOI: 10.7270/Q2FQ9XT7
					More data for this Ligand-Target Pair

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