Compile Data Set for Download or QSAR

Found 149 hits with Last Name = 'hijikata' and Initial = 'a'   

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
Plasminogen (Homo sapiens (Human))	BDBM50092333 (CHEMBL3084793 | Carbonic acid 4-{2-(4-acetyl-pheny...) Show SMILES CC(=O)c1ccc(NC(=O)C(Cc2ccc(OC(=O)OCc3ccccc3Br)cc2)NC(=O)[C@H]2CC[C@H](CN)CC2)cc1 |wU:36.38,wD:33.34,(8.83,-9.49,;7.29,-9.49,;6.52,-10.82,;6.52,-8.15,;7.29,-6.82,;6.52,-5.48,;4.98,-5.48,;4.21,-4.15,;2.67,-4.15,;1.9,-5.48,;1.9,-2.82,;2.67,-1.48,;4.21,-1.48,;4.98,-2.82,;6.52,-2.82,;7.29,-1.48,;8.83,-1.48,;9.6,-2.82,;8.83,-4.15,;11.14,-2.82,;11.91,-4.15,;13.45,-4.15,;14.22,-2.82,;15.76,-2.82,;16.53,-4.15,;15.76,-5.48,;14.22,-5.48,;13.45,-6.82,;6.52,-.15,;4.98,-.15,;.36,-2.82,;-.41,-4.15,;.36,-5.48,;-1.95,-4.15,;-2.72,-2.82,;-4.26,-2.82,;-5.03,-4.15,;-6.57,-4.15,;-7.34,-2.82,;-4.26,-5.48,;-2.72,-5.48,;4.21,-6.82,;4.98,-8.15,)| Show InChI InChI=1S/C33H36BrN3O6/c1-21(38)24-12-14-27(15-13-24)36-32(40)30(37-31(39)25-10-6-23(19-35)7-11-25)18-22-8-16-28(17-9-22)43-33(41)42-20-26-4-2-3-5-29(26)34/h2-5,8-9,12-17,23,25,30H,6-7,10-11,18-20,35H2,1H3,(H,36,40)(H,37,39)/t23-,25-,30?	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Inhibitory activity of compound was evaluated against plasmin				Bioorg Med Chem Lett 10: 2217-21 (2001) BindingDB Entry DOI: 10.7270/Q2125RXQ
					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
Plasminogen (Homo sapiens (Human))	BDBM50092338 (CHEMBL3084796 | Carbonic acid 4-[2-[(4-aminomethyl...) Show SMILES CC(C)CCNC(=O)C(Cc1ccc(OC(=O)OCc2ccccc2Br)cc1)NC(=O)[C@H]1CC[C@H](CN)CC1 |wU:34.36,wD:31.32,(11.12,-6.33,;10.62,-7.79,;11.62,-8.95,;9.1,-8.08,;8.09,-6.92,;6.58,-7.21,;5.57,-6.04,;6.08,-4.59,;4.06,-6.33,;3.05,-5.17,;3.56,-3.72,;5.07,-3.42,;5.57,-1.97,;4.57,-.81,;5.07,.65,;6.58,.94,;7.59,-.22,;7.09,2.4,;8.6,2.69,;9.1,4.14,;8.09,5.31,;8.6,6.76,;10.11,7.05,;11.12,5.89,;10.62,4.43,;11.62,3.27,;3.05,-1.1,;2.55,-2.55,;3.56,-7.79,;4.57,-8.95,;6.08,-8.66,;4.06,-10.41,;2.55,-10.7,;2.05,-12.16,;3.05,-13.32,;2.55,-14.77,;1.04,-15.07,;4.57,-13.03,;5.07,-11.57,)| Show InChI InChI=1S/C30H40BrN3O5/c1-20(2)15-16-33-29(36)27(34-28(35)23-11-7-22(18-32)8-12-23)17-21-9-13-25(14-10-21)39-30(37)38-19-24-5-3-4-6-26(24)31/h3-6,9-10,13-14,20,22-23,27H,7-8,11-12,15-19,32H2,1-2H3,(H,33,36)(H,34,35)/t22-,23-,27?	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	460	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Inhibitory activity of compound was evaluated against plasmin				Bioorg Med Chem Lett 10: 2217-21 (2001) BindingDB Entry DOI: 10.7270/Q2125RXQ
					More data for this Ligand-Target Pair
Plasminogen (Homo sapiens (Human))	BDBM50092331 (4-Aminomethyl-cyclohexanecarboxylic acid {1-octylc...) Show SMILES CCCCCCCCNC(=O)C(Cc1ccc(OCc2ccncc2)cc1)NC(=O)[C@H]1CC[C@H](CN)CC1 |wU:33.35,wD:30.31,(22.3,-4.53,;22.3,-2.99,;20.97,-2.22,;19.64,-2.99,;18.3,-2.22,;16.97,-2.99,;15.64,-2.22,;14.3,-2.99,;12.97,-2.22,;11.63,-2.99,;11.63,-4.53,;10.3,-2.22,;10.3,-.68,;11.63,.09,;12.97,-.68,;14.3,.09,;14.3,1.63,;15.64,2.4,;16.97,1.63,;18.3,2.4,;18.3,3.94,;19.64,4.71,;20.97,3.94,;20.97,2.4,;19.64,1.63,;12.97,2.4,;11.63,1.63,;8.97,-2.99,;8.97,-4.53,;10.3,-5.3,;7.63,-5.3,;6.3,-4.53,;4.97,-5.3,;4.97,-6.84,;3.63,-7.61,;2.3,-6.84,;6.3,-7.61,;7.63,-6.84,)| Show InChI InChI=1S/C31H46N4O3/c1-2-3-4-5-6-7-18-34-31(37)29(35-30(36)27-12-8-25(22-32)9-13-27)21-24-10-14-28(15-11-24)38-23-26-16-19-33-20-17-26/h10-11,14-17,19-20,25,27,29H,2-9,12-13,18,21-23,32H2,1H3,(H,34,37)(H,35,36)/t25-,27-,29?	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	530	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Inhibitory activity of compound was evaluated against plasmin				Bioorg Med Chem Lett 10: 2217-21 (2001) BindingDB Entry DOI: 10.7270/Q2125RXQ
					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
Plasminogen (Homo sapiens (Human))	BDBM50092335 (CHEMBL3084794 | Carbonic acid 4-{2-[(4-aminomethyl...) Show SMILES Cc1nc(C)c(CCCNC(=O)C(Cc2ccc(OC(=O)OCc3ccccc3Br)cc2)NC(=O)[C@H]2CC[C@H](CN)CC2)nc1O |wU:35.36,wD:38.40,(3.86,-9.45,;3.86,-7.91,;5.19,-7.14,;5.19,-5.6,;6.53,-4.83,;3.86,-4.83,;3.86,-3.29,;2.53,-2.52,;1.19,-3.29,;-.14,-2.52,;-1.47,-3.29,;-1.47,-4.83,;-2.81,-2.52,;-2.81,-.98,;-1.47,-.21,;-.14,-.98,;1.19,-.21,;1.19,1.33,;2.53,2.1,;3.86,1.33,;3.86,-.21,;5.19,2.1,;6.53,1.33,;7.86,2.1,;7.86,3.64,;9.2,4.41,;10.53,3.64,;10.53,2.1,;9.2,1.33,;9.2,-.21,;-.14,2.1,;-1.47,1.33,;-4.14,-3.29,;-4.14,-4.83,;-2.81,-5.6,;-5.48,-5.6,;-5.48,-7.14,;-6.81,-7.91,;-8.14,-7.14,;-9.48,-7.91,;-10.81,-7.14,;-8.14,-5.6,;-6.81,-4.83,;2.53,-5.6,;2.53,-7.14,;1.19,-7.91,)| Show InChI InChI=1S/C34H42BrN5O6/c1-21-29(39-31(41)22(2)38-21)8-5-17-37-33(43)30(40-32(42)25-13-9-24(19-36)10-14-25)18-23-11-15-27(16-12-23)46-34(44)45-20-26-6-3-4-7-28(26)35/h3-4,6-7,11-12,15-16,24-25,30H,5,8-10,13-14,17-20,36H2,1-2H3,(H,37,43)(H,39,41)(H,40,42)/t24-,25-,30?	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	740	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Inhibitory activity of compound was evaluated against plasmin; not detectable				Bioorg Med Chem Lett 10: 2217-21 (2001) BindingDB Entry DOI: 10.7270/Q2125RXQ
					More data for this Ligand-Target Pair
Plasminogen (Homo sapiens (Human))	BDBM50092332 (CHEMBL3084795 | Carbonic acid 4-{2-[(4-aminomethyl...) Show SMILES CCCCCCCCNC(=O)C(Cc1ccc(OC(=O)OCc2ccccc2Br)cc1)NC(=O)[C@H]1CC[C@H](CN)CC1 |wU:37.39,wD:34.35,(15.04,-7.34,;15.04,-5.8,;13.71,-5.03,;12.37,-5.8,;11.04,-5.03,;9.71,-5.8,;8.37,-5.03,;7.04,-5.8,;5.71,-5.03,;4.37,-5.8,;4.37,-7.34,;3.04,-5.03,;3.04,-3.49,;4.37,-2.72,;5.71,-3.49,;7.04,-2.72,;7.04,-1.18,;8.37,-.41,;9.71,-1.18,;9.71,-2.72,;11.04,-.41,;12.37,-1.18,;13.71,-.41,;13.71,1.13,;15.04,1.9,;16.37,1.13,;16.37,-.41,;15.04,-1.18,;15.04,-2.72,;5.71,-.41,;4.37,-1.18,;1.7,-5.8,;1.7,-7.34,;3.04,-8.11,;.37,-8.11,;-.96,-7.34,;-2.3,-8.11,;-2.3,-9.65,;-3.63,-10.42,;-4.96,-9.65,;-.96,-10.42,;.37,-9.65,)| Show InChI InChI=1S/C33H46BrN3O5/c1-2-3-4-5-6-9-20-36-32(39)30(37-31(38)26-16-12-25(22-35)13-17-26)21-24-14-18-28(19-15-24)42-33(40)41-23-27-10-7-8-11-29(27)34/h7-8,10-11,14-15,18-19,25-26,30H,2-6,9,12-13,16-17,20-23,35H2,1H3,(H,36,39)(H,37,38)/t25-,26-,30?	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Inhibitory activity of compound was evaluated against plasmin				Bioorg Med Chem Lett 10: 2217-21 (2001) BindingDB Entry DOI: 10.7270/Q2125RXQ
					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))	BDBM50404531 (CHEMBL166822) Show SMILES C\C=C\COC(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2c(cccc12)N(C)C Show InChI InChI=1S/C22H31N5O4S/c1-4-5-15-31-21(28)18(11-8-14-25-22(23)24)26-32(29,30)20-13-7-9-16-17(20)10-6-12-19(16)27(2)3/h4-7,9-10,12-13,18,26H,8,11,14-15H2,1-3H3,(H4,23,24,25)/b5-4+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration at which the clotting time was prolonged by twice the control was determined using topical bovine thrombin				J Med Chem 23: 827-30 (1980) BindingDB Entry DOI: 10.7270/Q2KH0PH2
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404506 (CHEMBL355622) Show SMILES CCCOC(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2c(cccc12)N(C)C Show InChI InChI=1S/C21H31N5O4S/c1-4-14-30-20(27)17(10-7-13-24-21(22)23)25-31(28,29)19-12-6-8-15-16(19)9-5-11-18(15)26(2)3/h5-6,8-9,11-12,17,25H,4,7,10,13-14H2,1-3H3,(H4,22,23,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration at which the clotting time was prolonged by twice the control was determined using topical bovine thrombin				J Med Chem 23: 827-30 (1980) BindingDB Entry DOI: 10.7270/Q2KH0PH2
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404530 (CHEMBL166995) Show SMILES CCCCOC(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2c(cccc12)N(C)C Show InChI InChI=1S/C22H33N5O4S/c1-4-5-15-31-21(28)18(11-8-14-25-22(23)24)26-32(29,30)20-13-7-9-16-17(20)10-6-12-19(16)27(2)3/h6-7,9-10,12-13,18,26H,4-5,8,11,14-15H2,1-3H3,(H4,23,24,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration at which the clotting time was prolonged by twice the control was determined using topical bovine thrombin				J Med Chem 23: 827-30 (1980) BindingDB Entry DOI: 10.7270/Q2KH0PH2
					More data for this Ligand-Target Pair
Plasminogen (Homo sapiens (Human))	BDBM50092334 (4-({2-[(4-Aminomethyl-cyclohexanecarbonyl)-amino]-...) Show SMILES CCCCCCCCOC(=O)[C@H]1CC[C@H](CNC(=O)C(Cc2ccc(OC(=O)OCc3ccccc3Br)cc2)NC(=O)[C@H]2CC[C@H](CN)CC2)CC1 |wU:42.43,14.14,wD:11.10,45.47,(22.77,-3.21,;21.44,-2.44,;20.1,-3.21,;18.77,-2.44,;17.44,-3.21,;16.1,-2.44,;14.77,-3.21,;13.44,-2.44,;12.1,-3.21,;10.77,-2.44,;10.77,-.9,;9.44,-3.21,;8.1,-2.44,;6.77,-3.21,;6.77,-4.75,;5.43,-5.52,;4.1,-4.75,;2.77,-5.52,;2.77,-7.06,;1.43,-4.75,;1.43,-3.21,;.1,-2.44,;.1,-.9,;-1.23,-.13,;-2.57,-.9,;-3.9,-.13,;-3.9,1.41,;-2.57,2.18,;-5.24,2.18,;-5.24,3.72,;-6.57,4.49,;-7.9,3.72,;-9.24,4.49,;-9.24,6.03,;-7.9,6.8,;-6.57,6.03,;-5.24,6.8,;-2.57,-2.44,;-1.23,-3.21,;.1,-5.52,;.1,-7.06,;1.43,-7.83,;-1.23,-7.83,;-1.23,-9.37,;-2.57,-10.14,;-3.9,-9.37,;-5.24,-10.14,;-6.57,-9.37,;-3.9,-7.83,;-2.57,-7.06,;8.1,-5.52,;9.44,-4.75,)| Show InChI InChI=1S/C41H58BrN3O7/c1-2-3-4-5-6-9-24-50-40(48)33-20-14-31(15-21-33)27-44-39(47)37(45-38(46)32-18-12-30(26-43)13-19-32)25-29-16-22-35(23-17-29)52-41(49)51-28-34-10-7-8-11-36(34)42/h7-8,10-11,16-17,22-23,30-33,37H,2-6,9,12-15,18-21,24-28,43H2,1H3,(H,44,47)(H,45,46)/t30-,31-,32-,33-,37?	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Inhibitory activity of compound was evaluated against plasmin				Bioorg Med Chem Lett 10: 2217-21 (2001) BindingDB Entry DOI: 10.7270/Q2125RXQ
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404522 (CHEMBL168689) Show SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)NC(CCCNC(N)=N)C(=O)OCCC#C Show InChI InChI=1S/C22H29N5O4S/c1-4-5-15-31-21(28)18(11-8-14-25-22(23)24)26-32(29,30)20-13-7-9-16-17(20)10-6-12-19(16)27(2)3/h1,6-7,9-10,12-13,18,26H,5,8,11,14-15H2,2-3H3,(H4,23,24,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration at which the clotting time was prolonged by twice the control was determined using topical bovine thrombin				J Med Chem 23: 827-30 (1980) BindingDB Entry DOI: 10.7270/Q2KH0PH2
					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))	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))	BDBM50404520 (CHEMBL167053) Show SMILES COCCOC(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2c(cccc12)N(C)C Show InChI InChI=1S/C21H31N5O5S/c1-26(2)18-10-4-8-16-15(18)7-5-11-19(16)32(28,29)25-17(9-6-12-24-21(22)23)20(27)31-14-13-30-3/h4-5,7-8,10-11,17,25H,6,9,12-14H2,1-3H3,(H4,22,23,24)	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 Concentration at which the clotting time was prolonged by twice the control was determined using topical bovine thrombin				J Med Chem 23: 827-30 (1980) BindingDB Entry DOI: 10.7270/Q2KH0PH2
					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))	BDBM50404516 (CHEMBL166790) Show SMILES CCOC(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2c(cccc12)N(C)C Show InChI InChI=1S/C20H29N5O4S/c1-4-29-19(26)16(10-7-13-23-20(21)22)24-30(27,28)18-12-6-8-14-15(18)9-5-11-17(14)25(2)3/h5-6,8-9,11-12,16,24H,4,7,10,13H2,1-3H3,(H4,21,22,23)	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 Concentration at which the clotting time was prolonged by twice the control was determined using topical bovine thrombin				J Med Chem 23: 827-30 (1980) BindingDB Entry DOI: 10.7270/Q2KH0PH2
					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))	BDBM50404511 (CHEMBL166334) Show SMILES CCCCCCOC(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2c(cccc12)N(C)C Show InChI InChI=1S/C24H37N5O4S/c1-4-5-6-7-17-33-23(30)20(13-10-16-27-24(25)26)28-34(31,32)22-15-9-11-18-19(22)12-8-14-21(18)29(2)3/h8-9,11-12,14-15,20,28H,4-7,10,13,16-17H2,1-3H3,(H4,25,26,27)	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 Concentration at which the clotting time was prolonged by twice the control was determined using topical bovine thrombin				J Med Chem 23: 827-30 (1980) BindingDB Entry DOI: 10.7270/Q2KH0PH2
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404518 (CHEMBL351664) Show SMILES CC(C)COC(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2c(cccc12)N(C)C Show InChI InChI=1S/C22H33N5O4S/c1-15(2)14-31-21(28)18(10-7-13-25-22(23)24)26-32(29,30)20-12-6-8-16-17(20)9-5-11-19(16)27(3)4/h5-6,8-9,11-12,15,18,26H,7,10,13-14H2,1-4H3,(H4,23,24,25)	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 Concentration at which the clotting time was prolonged by twice the control was determined using topical bovine thrombin				J Med Chem 23: 827-30 (1980) BindingDB Entry DOI: 10.7270/Q2KH0PH2
					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))	BDBM50404526 (CHEMBL350065) Show SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)NC(CCCNC(N)=N)C(=O)OCC1CCCO1 Show InChI InChI=1S/C23H33N5O5S/c1-28(2)20-11-3-9-18-17(20)8-4-12-21(18)34(30,31)27-19(10-5-13-26-23(24)25)22(29)33-15-16-7-6-14-32-16/h3-4,8-9,11-12,16,19,27H,5-7,10,13-15H2,1-2H3,(H4,24,25,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration at which the clotting time was prolonged by twice the control was determined using topical bovine thrombin				J Med Chem 23: 827-30 (1980) BindingDB Entry DOI: 10.7270/Q2KH0PH2
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404513 (CHEMBL166674) Show SMILES COC(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2c(cccc12)N(C)C Show InChI InChI=1S/C19H27N5O4S/c1-24(2)16-10-4-8-14-13(16)7-5-11-17(14)29(26,27)23-15(18(25)28-3)9-6-12-22-19(20)21/h4-5,7-8,10-11,15,23H,6,9,12H2,1-3H3,(H4,20,21,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration at which the clotting time was prolonged by twice the control was determined using topical bovine thrombin				J Med Chem 23: 827-30 (1980) BindingDB Entry DOI: 10.7270/Q2KH0PH2
					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))	BDBM50404523 (CHEMBL165880) Show SMILES CC(C)OC(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2c(cccc12)N(C)C Show InChI InChI=1S/C21H31N5O4S/c1-14(2)30-20(27)17(10-7-13-24-21(22)23)25-31(28,29)19-12-6-8-15-16(19)9-5-11-18(15)26(3)4/h5-6,8-9,11-12,14,17,25H,7,10,13H2,1-4H3,(H4,22,23,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration at which the clotting time was prolonged by twice the control was determined using topical bovine thrombin				J Med Chem 23: 827-30 (1980) BindingDB Entry DOI: 10.7270/Q2KH0PH2
					More data for this Ligand-Target Pair
Plasminogen (Homo sapiens (Human))	BDBM50451117 (CHEMBL3084798) Show SMILES NC[C@H]1CC[C@@H](CC1)C(=O)NC(Cc1ccc(Oc2ncccn2)cc1)C(=O)Nc1cccc(c1)C(O)=O |wU:2.1,wD:5.8,(-5.57,-3.35,;-4.8,-4.68,;-3.26,-4.68,;-2.49,-3.35,;-.95,-3.35,;-.18,-4.68,;-.95,-6.02,;-2.49,-6.02,;1.36,-4.68,;2.13,-6.02,;2.13,-3.35,;3.67,-3.35,;4.44,-2.02,;5.98,-2.02,;6.75,-3.35,;8.29,-3.35,;9.06,-2.02,;10.6,-2.02,;11.37,-.68,;12.91,-.68,;13.68,.65,;12.91,1.99,;11.37,1.99,;10.6,.65,;8.29,-.68,;6.75,-.68,;4.44,-4.68,;3.67,-6.02,;5.98,-4.68,;6.75,-6.02,;8.29,-6.02,;9.06,-7.35,;8.29,-8.68,;6.75,-8.68,;5.98,-7.35,;5.98,-10.02,;4.44,-10.02,;6.75,-11.35,)| Show InChI InChI=1S/C28H31N5O5/c29-17-19-5-9-20(10-6-19)25(34)33-24(26(35)32-22-4-1-3-21(16-22)27(36)37)15-18-7-11-23(12-8-18)38-28-30-13-2-14-31-28/h1-4,7-8,11-14,16,19-20,24H,5-6,9-10,15,17,29H2,(H,32,35)(H,33,34)(H,36,37)/t19-,20-,24?	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Inhibitory activity of compound was evaluated against plasmin				Bioorg Med Chem Lett 10: 2217-21 (2001) BindingDB Entry DOI: 10.7270/Q2125RXQ
					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))	BDBM50404527 (CHEMBL353733) Show SMILES CCCCCOC(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2c(cccc12)N(C)C Show InChI InChI=1S/C23H35N5O4S/c1-4-5-6-16-32-22(29)19(12-9-15-26-23(24)25)27-33(30,31)21-14-8-10-17-18(21)11-7-13-20(17)28(2)3/h7-8,10-11,13-14,19,27H,4-6,9,12,15-16H2,1-3H3,(H4,24,25,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration at which the clotting time was prolonged by twice the control was determined using topical bovine thrombin				J Med Chem 23: 827-30 (1980) BindingDB Entry DOI: 10.7270/Q2KH0PH2
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404515 (CHEMBL353241) Show SMILES CCCCC(CC)COC(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2c(cccc12)N(C)C Show InChI InChI=1S/C26H41N5O4S/c1-5-7-11-19(6-2)18-35-25(32)22(14-10-17-29-26(27)28)30-36(33,34)24-16-9-12-20-21(24)13-8-15-23(20)31(3)4/h8-9,12-13,15-16,19,22,30H,5-7,10-11,14,17-18H2,1-4H3,(H4,27,28,29)	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 Concentration at which the clotting time was prolonged by twice the control was determined using topical bovine thrombin				J Med Chem 23: 827-30 (1980) BindingDB Entry DOI: 10.7270/Q2KH0PH2
					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))	BDBM50404505 (CHEMBL434874) Show SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)NC(CCCNC(N)=N)C(=O)OC1CCCCC1 Show InChI InChI=1S/C24H35N5O4S/c1-29(2)21-14-6-12-19-18(21)11-7-15-22(19)34(31,32)28-20(13-8-16-27-24(25)26)23(30)33-17-9-4-3-5-10-17/h6-7,11-12,14-15,17,20,28H,3-5,8-10,13,16H2,1-2H3,(H4,25,26,27)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	6.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration at which the clotting time was prolonged by twice the control was determined using topical bovine thrombin				J Med Chem 23: 827-30 (1980) BindingDB Entry DOI: 10.7270/Q2KH0PH2
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404517 (CHEMBL354949) Show SMILES COC(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2cc(ccc12)N(C)C Show InChI InChI=1S/C19H27N5O4S/c1-24(2)14-9-10-15-13(12-14)6-4-8-17(15)29(26,27)23-16(18(25)28-3)7-5-11-22-19(20)21/h4,6,8-10,12,16,23H,5,7,11H2,1-3H3,(H4,20,21,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration at which the clotting time was prolonged by twice the control was determined using topical bovine thrombin				J Med Chem 23: 827-30 (1980) BindingDB Entry DOI: 10.7270/Q2KH0PH2
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404529 (CHEMBL354968) Show SMILES COC(=O)C(CCCNC(N)=N)NS(=O)(=O)c1ccc(OC)cc1 Show InChI InChI=1S/C14H22N4O5S/c1-22-10-5-7-11(8-6-10)24(20,21)18-12(13(19)23-2)4-3-9-17-14(15)16/h5-8,12,18H,3-4,9H2,1-2H3,(H4,15,16,17)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration at which the clotting time was prolonged by twice the control was determined using topical bovine thrombin				J Med Chem 23: 827-30 (1980) BindingDB Entry DOI: 10.7270/Q2KH0PH2
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404519 (CHEMBL349867) Show SMILES COC(=O)C(CCCNC(N)=N)NS(=O)(=O)c1ccc2ccccc2c1 Show InChI InChI=1S/C17H22N4O4S/c1-25-16(22)15(7-4-10-20-17(18)19)21-26(23,24)14-9-8-12-5-2-3-6-13(12)11-14/h2-3,5-6,8-9,11,15,21H,4,7,10H2,1H3,(H4,18,19,20)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.30E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration at which the clotting time was prolonged by twice the control was determined using topical bovine thrombin				J Med Chem 23: 827-30 (1980) BindingDB Entry DOI: 10.7270/Q2KH0PH2
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404509 (CHEMBL170274) Show SMILES CCC(COC(=O)C(CCC[N-]C(N)=[NH2+])NS(=O)(=O)c1cccc2c(cccc12)N(C)C)[N+]([O-])=O Show InChI InChI=1S/C22H31N6O6S/c1-4-15(28(30)31)14-34-21(29)18(10-7-13-25-22(23)24)26-35(32,33)20-12-6-8-16-17(20)9-5-11-19(16)27(2)3/h5-6,8-9,11-12,15,18,26H,4,7,10,13-14H2,1-3H3,(H3-,23,24,25)/q-1/p+1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration at which the clotting time was prolonged by twice the control was determined using topical bovine thrombin				J Med Chem 23: 827-30 (1980) BindingDB Entry DOI: 10.7270/Q2KH0PH2
					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
Plasminogen (Homo sapiens (Human))	BDBM50092337 ((4-{2-[(4-Aminomethyl-cyclohexanecarbonyl)-amino]-...) Show SMILES NC[C@H]1CC[C@@H](CC1)C(=O)NC(Cc1ccccc1)C(=O)Nc1ccc(CC(O)=O)cc1 |wU:2.1,wD:5.8,(2.07,-8.95,;3.4,-9.72,;4.74,-8.95,;4.74,-7.41,;6.07,-6.64,;7.4,-7.41,;7.4,-8.95,;6.07,-9.72,;8.74,-6.64,;8.74,-5.1,;10.07,-7.41,;11.4,-6.64,;11.4,-5.1,;12.74,-4.33,;12.74,-2.79,;14.07,-2.02,;15.4,-2.79,;15.4,-4.33,;14.07,-5.1,;12.74,-7.41,;12.74,-8.95,;14.07,-6.64,;15.4,-7.41,;16.74,-6.64,;18.07,-7.41,;18.07,-8.95,;19.41,-9.72,;19.41,-11.26,;18.07,-12.03,;20.74,-12.03,;16.74,-9.72,;15.4,-8.95,)| Show InChI InChI=1S/C25H31N3O4/c26-16-19-6-10-20(11-7-19)24(31)28-22(14-17-4-2-1-3-5-17)25(32)27-21-12-8-18(9-13-21)15-23(29)30/h1-5,8-9,12-13,19-20,22H,6-7,10-11,14-16,26H2,(H,27,32)(H,28,31)(H,29,30)/t19-,20-,22?	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents	PubMed	n/a	n/a	6.20E+5	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Inhibitory activity of compound was evaluated against plasmin				Bioorg Med Chem Lett 10: 2217-21 (2001) BindingDB Entry DOI: 10.7270/Q2125RXQ
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50070707 ((S)-5-Guanidino-2-(toluene-4-sulfonylamino)-pentan...) Show SMILES COC(=O)[C@H](CCCNC(N)=N)NS(=O)(=O)c1ccc(C)cc1 Show InChI InChI=1S/C14H22N4O4S/c1-10-5-7-11(8-6-10)23(20,21)18-12(13(19)22-2)4-3-9-17-14(15)16/h5-8,12,18H,3-4,9H2,1-2H3,(H4,15,16,17)/t12-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration at which the clotting time was prolonged by twice the control was determined using topical bovine thrombin				J Med Chem 23: 827-30 (1980) BindingDB Entry DOI: 10.7270/Q2KH0PH2
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404507 (CHEMBL423263) Show SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)NC(CCCNC(N)=N)C(O)=O Show InChI InChI=1S/C18H25N5O4S/c1-23(2)15-9-3-7-13-12(15)6-4-10-16(13)28(26,27)22-14(17(24)25)8-5-11-21-18(19)20/h3-4,6-7,9-10,14,22H,5,8,11H2,1-2H3,(H,24,25)(H4,19,20,21)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Similars	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration at which the clotting time was prolonged by twice the control was determined using topical bovine thrombin				J Med Chem 23: 827-30 (1980) BindingDB Entry DOI: 10.7270/Q2KH0PH2
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404521 (CHEMBL353107) Show SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)NC(CCCNC(N)=N)C(=O)OCc1ccccc1 Show InChI InChI=1S/C25H31N5O4S/c1-30(2)22-14-6-12-20-19(22)11-7-15-23(20)35(32,33)29-21(13-8-16-28-25(26)27)24(31)34-17-18-9-4-3-5-10-18/h3-7,9-12,14-15,21,29H,8,13,16-17H2,1-2H3,(H4,26,27,28)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration at which the clotting time was prolonged by twice the control was determined using topical bovine thrombin				J Med Chem 23: 827-30 (1980) BindingDB Entry DOI: 10.7270/Q2KH0PH2
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404512 (CHEMBL168250) Show SMILES CCC(C)OC(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2c(cccc12)N(C)C Show InChI InChI=1S/C22H33N5O4S/c1-5-15(2)31-21(28)18(11-8-14-25-22(23)24)26-32(29,30)20-13-7-9-16-17(20)10-6-12-19(16)27(3)4/h6-7,9-10,12-13,15,18,26H,5,8,11,14H2,1-4H3,(H4,23,24,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration at which the clotting time was prolonged by twice the control was determined using topical bovine thrombin				J Med Chem 23: 827-30 (1980) BindingDB Entry DOI: 10.7270/Q2KH0PH2
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404513 (CHEMBL166674) Show SMILES COC(=O)C(CCCNC(N)=N)NS(=O)(=O)c1cccc2c(cccc12)N(C)C Show InChI InChI=1S/C19H27N5O4S/c1-24(2)16-10-4-8-14-13(16)7-5-11-17(14)29(26,27)23-15(18(25)28-3)9-6-12-22-19(20)21/h4-5,7-8,10-11,15,23H,6,9,12H2,1-3H3,(H4,20,21,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration at which the clotting time was prolonged by twice the control was determined using commercial topical bovine thrombin.				J Med Chem 23: 827-30 (1980) BindingDB Entry DOI: 10.7270/Q2KH0PH2
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404525 (CHEMBL167794) Show SMILES COC(=O)C(CCC[N-]C(N)=[NH2+])NS(=O)(=O)c1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C13H18N5O6S/c1-24-12(19)11(3-2-8-16-13(14)15)17-25(22,23)10-6-4-9(5-7-10)18(20)21/h4-7,11,17H,2-3,8H2,1H3,(H3-,14,15,16)/q-1/p+1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.40E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration at which the clotting time was prolonged by twice the control was determined using topical bovine thrombin				J Med Chem 23: 827-30 (1980) BindingDB Entry DOI: 10.7270/Q2KH0PH2
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404524 (CHEMBL168759) Show SMILES COC(=O)C(CCCNC(N)=N)NS(=O)(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C13H19ClN4O4S/c1-22-12(19)11(3-2-8-17-13(15)16)18-23(20,21)10-6-4-9(14)5-7-10/h4-7,11,18H,2-3,8H2,1H3,(H4,15,16,17)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.70E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration at which the clotting time was prolonged by twice the control was determined using topical bovine thrombin				J Med Chem 23: 827-30 (1980) BindingDB Entry DOI: 10.7270/Q2KH0PH2
					More data for this Ligand-Target Pair
Prothrombin (Bos taurus (Bovine))	BDBM50404528 (CHEMBL422559) Show SMILES COC(=O)C(CCC[N-]C(N)=[NH2+])NS(=O)(=O)c1cccc(c1)[N+]([O-])=O Show InChI InChI=1S/C13H18N5O6S/c1-24-12(19)11(6-3-7-16-13(14)15)17-25(22,23)10-5-2-4-9(8-10)18(20)21/h2,4-5,8,11,17H,3,6-7H2,1H3,(H3-,14,15,16)/q-1/p+1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.90E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration at which the clotting time was prolonged by twice the control was determined using topical bovine thrombin				J Med Chem 23: 827-30 (1980) BindingDB Entry DOI: 10.7270/Q2KH0PH2
					More data for this Ligand-Target Pair

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