Compile Data Set for Download or QSAR

Found 108 hits with Last Name = 'duffy' and Initial = 'de'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Prothrombin (Homo sapiens (Human))	BDBM50451005 (CHEMBL290376 | DuP-714) Show SMILES CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(N)=N)B(O)O |r| Show InChI InChI=1S/C21H33BN6O5/c1-14(29)26-16(13-15-7-3-2-4-8-15)20(31)28-12-6-9-17(28)19(30)27-18(22(32)33)10-5-11-25-21(23)24/h2-4,7-8,16-18,32-33H,5-6,9-13H2,1H3,(H,26,29)(H,27,30)(H4,23,24,25)/t16-,17+,18+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	PDB PubMed	0.0420	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of Coagulation factor II				Bioorg Med Chem Lett 9: 925-30 (1999) BindingDB Entry DOI: 10.7270/Q2KS6QQ6
					More data for this Ligand-Target Pair				3D Structure (crystal)
Coagulation factor X (Homo sapiens (Human))	BDBM50094092 (CHEMBL336661 | N-(3-Bromo-2'-sulfamoyl-biphenyl-4-...) Show SMILES NC(=N)c1ccc2[nH]cc(CC(=O)Nc3ccc(cc3Br)-c3ccccc3S(N)(=O)=O)c2c1 Show InChI InChI=1S/C23H20BrN5O3S/c24-18-10-13(16-3-1-2-4-21(16)33(27,31)32)5-8-20(18)29-22(30)11-15-12-28-19-7-6-14(23(25)26)9-17(15)19/h1-10,12,28H,11H2,(H3,25,26)(H,29,30)(H2,27,31,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.320	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human coagulation factor X				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50094100 (2-(5-Carbamimidoyl-1H-indol-3-yl)-N-(3-iodo-2'-sul...) Show SMILES NC(=N)c1ccc2[nH]cc(CC(=O)Nc3ccc(cc3I)-c3ccccc3S(N)(=O)=O)c2c1 Show InChI InChI=1S/C23H20IN5O3S/c24-18-10-13(16-3-1-2-4-21(16)33(27,31)32)5-8-20(18)29-22(30)11-15-12-28-19-7-6-14(23(25)26)9-17(15)19/h1-10,12,28H,11H2,(H3,25,26)(H,29,30)(H2,27,31,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.600	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human coagulation factor X				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50094096 (2-(5-Carbamimidoyl-1H-indol-3-yl)-N-(3-chloro-2'-s...) Show SMILES NC(=N)c1ccc2[nH]cc(CC(=O)Nc3ccc(cc3Cl)-c3ccccc3S(N)(=O)=O)c2c1 Show InChI InChI=1S/C23H20ClN5O3S/c24-18-10-13(16-3-1-2-4-21(16)33(27,31)32)5-8-20(18)29-22(30)11-15-12-28-19-7-6-14(23(25)26)9-17(15)19/h1-10,12,28H,11H2,(H3,25,26)(H,29,30)(H2,27,31,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.700	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human coagulation factor X				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50094096 (2-(5-Carbamimidoyl-1H-indol-3-yl)-N-(3-chloro-2'-s...) Show SMILES NC(=N)c1ccc2[nH]cc(CC(=O)Nc3ccc(cc3Cl)-c3ccccc3S(N)(=O)=O)c2c1 Show InChI InChI=1S/C23H20ClN5O3S/c24-18-10-13(16-3-1-2-4-21(16)33(27,31)32)5-8-20(18)29-22(30)11-15-12-28-19-7-6-14(23(25)26)9-17(15)19/h1-10,12,28H,11H2,(H3,25,26)(H,29,30)(H2,27,31,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.790	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against Coagulation factor X from rabbit purified enzyme				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50094092 (CHEMBL336661 | N-(3-Bromo-2'-sulfamoyl-biphenyl-4-...) Show SMILES NC(=N)c1ccc2[nH]cc(CC(=O)Nc3ccc(cc3Br)-c3ccccc3S(N)(=O)=O)c2c1 Show InChI InChI=1S/C23H20BrN5O3S/c24-18-10-13(16-3-1-2-4-21(16)33(27,31)32)5-8-20(18)29-22(30)11-15-12-28-19-7-6-14(23(25)26)9-17(15)19/h1-10,12,28H,11H2,(H3,25,26)(H,29,30)(H2,27,31,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.900	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against Coagulation factor X from rabbit purified enzyme				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50094115 (2-(5-Carbamimidoyl-1H-indol-3-yl)-N-[5-(2-sulfamoy...) Show SMILES NC(=N)c1ccc2[nH]cc(CC(=O)Nc3ccc(cn3)-c3ccccc3S(N)(=O)=O)c2c1 Show InChI InChI=1S/C22H20N6O3S/c23-22(24)13-5-7-18-17(9-13)15(12-26-18)10-21(29)28-20-8-6-14(11-27-20)16-3-1-2-4-19(16)32(25,30)31/h1-9,11-12,26H,10H2,(H3,23,24)(H2,25,30,31)(H,27,28,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.920	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human coagulation factor X				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50094115 (2-(5-Carbamimidoyl-1H-indol-3-yl)-N-[5-(2-sulfamoy...) Show SMILES NC(=N)c1ccc2[nH]cc(CC(=O)Nc3ccc(cn3)-c3ccccc3S(N)(=O)=O)c2c1 Show InChI InChI=1S/C22H20N6O3S/c23-22(24)13-5-7-18-17(9-13)15(12-26-18)10-21(29)28-20-8-6-14(11-27-20)16-3-1-2-4-19(16)32(25,30)31/h1-9,11-12,26H,10H2,(H3,23,24)(H2,25,30,31)(H,27,28,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.920	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human coagulation factor X				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50094115 (2-(5-Carbamimidoyl-1H-indol-3-yl)-N-[5-(2-sulfamoy...) Show SMILES NC(=N)c1ccc2[nH]cc(CC(=O)Nc3ccc(cn3)-c3ccccc3S(N)(=O)=O)c2c1 Show InChI InChI=1S/C22H20N6O3S/c23-22(24)13-5-7-18-17(9-13)15(12-26-18)10-21(29)28-20-8-6-14(11-27-20)16-3-1-2-4-19(16)32(25,30)31/h1-9,11-12,26H,10H2,(H3,23,24)(H2,25,30,31)(H,27,28,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.930	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against Coagulation factor X from rabbit purified enzyme				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM12775 (2-(5-carbamimidoyl-1H-indol-3-yl)-N-[4-(2-sulfamoy...) Show SMILES NC(=N)c1ccc2[nH]cc(CC(=O)Nc3ccc(cc3)-c3ccccc3S(N)(=O)=O)c2c1 Show InChI InChI=1S/C23H21N5O3S/c24-23(25)15-7-10-20-19(11-15)16(13-27-20)12-22(29)28-17-8-5-14(6-9-17)18-3-1-2-4-21(18)32(26,30)31/h1-11,13,27H,12H2,(H3,24,25)(H,28,29)(H2,26,30,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	2.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human coagulation factor X				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50094102 (2-(5-Carbamimidoyl-1H-indol-3-yl)-N-(3-methyl-2'-s...) Show SMILES Cc1cc(ccc1NC(=O)Cc1c[nH]c2ccc(cc12)C(N)=N)-c1ccccc1S(N)(=O)=O Show InChI InChI=1S/C24H23N5O3S/c1-14-10-15(18-4-2-3-5-22(18)33(27,31)32)6-8-20(14)29-23(30)12-17-13-28-21-9-7-16(24(25)26)11-19(17)21/h2-11,13,28H,12H2,1H3,(H3,25,26)(H,29,30)(H2,27,31,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human coagulation factor X				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50094114 (2-(6-Carbamimidoyl-benzoimidazol-1-yl)-N-(2'-sulfa...) Show SMILES NC(=N)c1ccc2ncn(CC(=O)Nc3ccc(cc3)-c3ccccc3S(N)(=O)=O)c2c1 Show InChI InChI=1S/C22H20N6O3S/c23-22(24)15-7-10-18-19(11-15)28(13-26-18)12-21(29)27-16-8-5-14(6-9-16)17-3-1-2-4-20(17)32(25,30)31/h1-11,13H,12H2,(H3,23,24)(H,27,29)(H2,25,30,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human coagulation factor X				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50094097 (2-(5-Carbamimidoyl-1H-indol-3-yl)-N-(3-fluoro-2'-s...) Show SMILES NC(=N)c1ccc2[nH]cc(CC(=O)Nc3ccc(cc3F)-c3ccccc3S(N)(=O)=O)c2c1 Show InChI InChI=1S/C23H20FN5O3S/c24-18-10-13(16-3-1-2-4-21(16)33(27,31)32)5-8-20(18)29-22(30)11-15-12-28-19-7-6-14(23(25)26)9-17(15)19/h1-10,12,28H,11H2,(H3,25,26)(H,29,30)(H2,27,31,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human coagulation factor X				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50094094 (2-(6-Carbamimidoyl-indazol-1-yl)-N-[5-(2-sulfamoyl...) Show SMILES NC(=N)c1ccc2cnn(CC(=O)Nc3ccc(cn3)-c3ccccc3S(N)(=O)=O)c2c1 Show InChI InChI=1S/C21H19N7O3S/c22-21(23)13-5-6-15-11-26-28(17(15)9-13)12-20(29)27-19-8-7-14(10-25-19)16-3-1-2-4-18(16)32(24,30)31/h1-11H,12H2,(H3,22,23)(H2,24,30,31)(H,25,27,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	3.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human coagulation factor X				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50094091 (2-(5-Carbamimidoyl-1H-indol-3-yl)-N-(2'-methylsulf...) Show SMILES CNS(=O)(=O)c1ccccc1-c1ccc(NC(=O)Cc2c[nH]c3ccc(cc23)C(N)=N)cc1 Show InChI InChI=1S/C24H23N5O3S/c1-27-33(31,32)22-5-3-2-4-19(22)15-6-9-18(10-7-15)29-23(30)13-17-14-28-21-11-8-16(24(25)26)12-20(17)21/h2-12,14,27-28H,13H2,1H3,(H3,25,26)(H,29,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human coagulation factor X				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50094113 (2-(5-Carbamimidoyl-1H-indol-3-yl)-N-(2'-ethylsulfa...) Show SMILES CCNS(=O)(=O)c1ccccc1-c1ccc(NC(=O)Cc2c[nH]c3ccc(cc23)C(N)=N)cc1 Show InChI InChI=1S/C25H25N5O3S/c1-2-29-34(32,33)23-6-4-3-5-20(23)16-7-10-19(11-8-16)30-24(31)14-18-15-28-22-12-9-17(25(26)27)13-21(18)22/h3-13,15,28-29H,2,14H2,1H3,(H3,26,27)(H,30,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human coagulation factor X				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM12775 (2-(5-carbamimidoyl-1H-indol-3-yl)-N-[4-(2-sulfamoy...) Show SMILES NC(=N)c1ccc2[nH]cc(CC(=O)Nc3ccc(cc3)-c3ccccc3S(N)(=O)=O)c2c1 Show InChI InChI=1S/C23H21N5O3S/c24-23(25)15-7-10-20-19(11-15)16(13-27-20)12-22(29)28-17-8-5-14(6-9-17)18-3-1-2-4-21(18)32(26,30)31/h1-11,13,27H,12H2,(H3,24,25)(H,28,29)(H2,26,30,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against fXa from rabbit purified enzyme				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50072445 (CHEMBL139063 | CHEMBL279628 | [3-(3-Carbamimidoyl-...) Show SMILES COC(=O)CC1(CC(=NO1)c1cccc(c1)C(N)=N)C(=O)Nc1ccc(cc1)-c1ccccc1S(N)(=O)=O |c:7| Show InChI InChI=1S/C26H25N5O6S/c1-36-23(32)15-26(14-21(31-37-26)17-5-4-6-18(13-17)24(27)28)25(33)30-19-11-9-16(10-12-19)20-7-2-3-8-22(20)38(29,34)35/h2-13H,14-15H2,1H3,(H3,27,28)(H,30,33)(H2,29,34,35)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	6.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human coagulation factor X				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50094093 (2-(5-Carbamimidoyl-1H-indol-3-yl)-N-(2'-dimethylsu...) Show SMILES CN(C)S(=O)(=O)c1ccccc1-c1ccc(NC(=O)Cc2c[nH]c3ccc(cc23)C(N)=N)cc1 Show InChI InChI=1S/C25H25N5O3S/c1-30(2)34(32,33)23-6-4-3-5-20(23)16-7-10-19(11-8-16)29-24(31)14-18-15-28-22-12-9-17(25(26)27)13-21(18)22/h3-13,15,28H,14H2,1-2H3,(H3,26,27)(H,29,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human coagulation factor X				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50076548 (1-[2-(4-Benzyl-piperidin-1-yl)-2-oxo-ethyl]-3-(2-h...) Show SMILES NC(=N)c1ccc2n(CC(=O)N3CCC(Cc4ccccc4)CC3)cc(CCO)c2c1 Show InChI InChI=1S/C25H30N4O2/c26-25(27)20-6-7-23-22(15-20)21(10-13-30)16-29(23)17-24(31)28-11-8-19(9-12-28)14-18-4-2-1-3-5-18/h1-7,15-16,19,30H,8-14,17H2,(H3,26,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of Coagulation factor II				Bioorg Med Chem Lett 9: 925-30 (1999) BindingDB Entry DOI: 10.7270/Q2KS6QQ6
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50076545 (CHEMBL422722 | {1-[2-(4-Benzyl-piperidin-1-yl)-2-o...) Show SMILES COC(=O)Cc1cn(CC(=O)N2CCC(Cc3ccccc3)CC2)c2ccc(cc12)C(N)=N Show InChI InChI=1S/C26H30N4O3/c1-33-25(32)15-21-16-30(23-8-7-20(26(27)28)14-22(21)23)17-24(31)29-11-9-19(10-12-29)13-18-5-3-2-4-6-18/h2-8,14,16,19H,9-13,15,17H2,1H3,(H3,27,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	7.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of Coagulation factor II				Bioorg Med Chem Lett 9: 925-30 (1999) BindingDB Entry DOI: 10.7270/Q2KS6QQ6
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50094104 (2-(5-Carbamimidoyl-1H-indol-3-yl)-N-(2'-propylsulf...) Show SMILES CCCNS(=O)(=O)c1ccccc1-c1ccc(NC(=O)Cc2c[nH]c3ccc(cc23)C(N)=N)cc1 Show InChI InChI=1S/C26H27N5O3S/c1-2-13-30-35(33,34)24-6-4-3-5-21(24)17-7-10-20(11-8-17)31-25(32)15-19-16-29-23-12-9-18(26(27)28)14-22(19)23/h3-12,14,16,29-30H,2,13,15H2,1H3,(H3,27,28)(H,31,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human coagulation factor X				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Serine protease 1 (Homo sapiens (Human))	BDBM50451005 (CHEMBL290376 | DuP-714) Show SMILES CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(N)=N)B(O)O |r| Show InChI InChI=1S/C21H33BN6O5/c1-14(29)26-16(13-15-7-3-2-4-8-15)20(31)28-12-6-9-17(28)19(30)27-18(22(32)33)10-5-11-25-21(23)24/h2-4,7-8,16-18,32-33H,5-6,9-13H2,1H3,(H,26,29)(H,27,30)(H4,23,24,25)/t16-,17+,18+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	PubMed	9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibitory activity of the compound against trypsin				Bioorg Med Chem Lett 9: 925-30 (1999) BindingDB Entry DOI: 10.7270/Q2KS6QQ6
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50076540 (1-[2-(4-Benzyl-piperidin-1-yl)-2-oxo-ethyl]-1H-ind...) Show SMILES NC(=N)c1ccc2n(CC(=O)N3CCC(Cc4ccccc4)CC3)ccc2c1 Show InChI InChI=1S/C23H26N4O/c24-23(25)20-6-7-21-19(15-20)10-13-27(21)16-22(28)26-11-8-18(9-12-26)14-17-4-2-1-3-5-17/h1-7,10,13,15,18H,8-9,11-12,14,16H2,(H3,24,25)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	18	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of Coagulation factor II				Bioorg Med Chem Lett 9: 925-30 (1999) BindingDB Entry DOI: 10.7270/Q2KS6QQ6
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50076549 (CHEMBL366643 | {1-[2-(4-Benzyl-piperidin-1-yl)-2-o...) Show SMILES NC(=N)c1ccc2n(CC(=O)N3CCC(Cc4ccccc4)CC3)cc(CC(O)=O)c2c1 Show InChI InChI=1S/C25H28N4O3/c26-25(27)19-6-7-22-21(13-19)20(14-24(31)32)15-29(22)16-23(30)28-10-8-18(9-11-28)12-17-4-2-1-3-5-17/h1-7,13,15,18H,8-12,14,16H2,(H3,26,27)(H,31,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	19	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of Coagulation factor II				Bioorg Med Chem Lett 9: 925-30 (1999) BindingDB Entry DOI: 10.7270/Q2KS6QQ6
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50076547 (1-{2-[4-(2-Fluoro-benzyl)-piperidin-1-yl]-2-oxo-et...) Show SMILES NC(=N)c1ccc2n(CC(=O)N3CCC(Cc4ccccc4F)CC3)ccc2c1 Show InChI InChI=1S/C23H25FN4O/c24-20-4-2-1-3-17(20)13-16-7-10-27(11-8-16)22(29)15-28-12-9-18-14-19(23(25)26)5-6-21(18)28/h1-6,9,12,14,16H,7-8,10-11,13,15H2,(H3,25,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	24	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of Coagulation factor II				Bioorg Med Chem Lett 9: 925-30 (1999) BindingDB Entry DOI: 10.7270/Q2KS6QQ6
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50076538 (1-{2-[4-(3-Fluoro-benzyl)-piperidin-1-yl]-2-oxo-et...) Show SMILES NC(=N)c1ccc2n(CC(=O)N3CCC(Cc4cccc(F)c4)CC3)ccc2c1 Show InChI InChI=1S/C23H25FN4O/c24-20-3-1-2-17(13-20)12-16-6-9-27(10-7-16)22(29)15-28-11-8-18-14-19(23(25)26)4-5-21(18)28/h1-5,8,11,13-14,16H,6-7,9-10,12,15H2,(H3,25,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	24	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of Coagulation factor II				Bioorg Med Chem Lett 9: 925-30 (1999) BindingDB Entry DOI: 10.7270/Q2KS6QQ6
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50076537 (3-{1-[2-(4-Benzyl-piperidin-1-yl)-2-oxo-ethyl]-5-c...) Show SMILES COC(=O)\C=C\c1cn(CC(=O)N2CCC(Cc3ccccc3)CC2)c2ccc(cc12)C(N)=N Show InChI InChI=1S/C27H30N4O3/c1-34-26(33)10-8-22-17-31(24-9-7-21(27(28)29)16-23(22)24)18-25(32)30-13-11-20(12-14-30)15-19-5-3-2-4-6-19/h2-10,16-17,20H,11-15,18H2,1H3,(H3,28,29)/b10-8+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	28	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of Coagulation factor II				Bioorg Med Chem Lett 9: 925-30 (1999) BindingDB Entry DOI: 10.7270/Q2KS6QQ6
					More data for this Ligand-Target Pair
Serine protease 1 (Homo sapiens (Human))	BDBM50094094 (2-(6-Carbamimidoyl-indazol-1-yl)-N-[5-(2-sulfamoyl...) Show SMILES NC(=N)c1ccc2cnn(CC(=O)Nc3ccc(cn3)-c3ccccc3S(N)(=O)=O)c2c1 Show InChI InChI=1S/C21H19N7O3S/c22-21(23)13-5-6-15-11-26-28(17(15)9-13)12-20(29)27-19-8-7-14(10-25-19)16-3-1-2-4-18(16)32(24,30)31/h1-11H,12H2,(H3,22,23)(H2,24,30,31)(H,25,27,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	41	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human trypsin				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50094109 (2-(5-Carbamimidoyl-1H-indol-3-yl)-N-methyl-N-(2'-s...) Show SMILES CN(C(=O)Cc1c[nH]c2ccc(cc12)C(N)=N)c1ccc(cc1)-c1ccccc1S(N)(=O)=O Show InChI InChI=1S/C24H23N5O3S/c1-29(23(30)13-17-14-28-21-11-8-16(24(25)26)12-20(17)21)18-9-6-15(7-10-18)19-4-2-3-5-22(19)33(27,31)32/h2-12,14,28H,13H2,1H3,(H3,25,26)(H2,27,31,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	41	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human coagulation factor X				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Serine protease 1 (Homo sapiens (Human))	BDBM50094114 (2-(6-Carbamimidoyl-benzoimidazol-1-yl)-N-(2'-sulfa...) Show SMILES NC(=N)c1ccc2ncn(CC(=O)Nc3ccc(cc3)-c3ccccc3S(N)(=O)=O)c2c1 Show InChI InChI=1S/C22H20N6O3S/c23-22(24)15-7-10-18-19(11-15)28(13-26-18)12-21(29)27-16-8-5-14(6-9-16)17-3-1-2-4-20(17)32(25,30)31/h1-11,13H,12H2,(H3,23,24)(H,27,29)(H2,25,30,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	47	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human trypsin				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50094090 (2-(5-Carbamimidoyl-2,3-dihydro-1H-indol-3-yl)-N-(2...) Show SMILES NC(=N)c1ccc2NCC(CC(=O)Nc3ccc(cc3)-c3ccccc3S(N)(=O)=O)c2c1 Show InChI InChI=1S/C23H23N5O3S/c24-23(25)15-7-10-20-19(11-15)16(13-27-20)12-22(29)28-17-8-5-14(6-9-17)18-3-1-2-4-21(18)32(26,30)31/h1-11,16,27H,12-13H2,(H3,24,25)(H,28,29)(H2,26,30,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	52	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human coagulation factor X				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50094090 (2-(5-Carbamimidoyl-2,3-dihydro-1H-indol-3-yl)-N-(2...) Show SMILES NC(=N)c1ccc2NCC(CC(=O)Nc3ccc(cc3)-c3ccccc3S(N)(=O)=O)c2c1 Show InChI InChI=1S/C23H23N5O3S/c24-23(25)15-7-10-20-19(11-15)16(13-27-20)12-22(29)28-17-8-5-14(6-9-17)18-3-1-2-4-21(18)32(26,30)31/h1-11,16,27H,12-13H2,(H3,24,25)(H,28,29)(H2,26,30,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	52	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human coagulation factor X				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50094110 (2-(5-Carbamimidoyl-1-methyl-1H-indol-3-yl)-N-[5-(2...) Show SMILES Cn1cc(CC(=O)Nc2ccc(cn2)-c2ccccc2S(N)(=O)=O)c2cc(ccc12)C(N)=N Show InChI InChI=1S/C23H22N6O3S/c1-29-13-16(18-10-14(23(24)25)6-8-19(18)29)11-22(30)28-21-9-7-15(12-27-21)17-4-2-3-5-20(17)33(26,31)32/h2-10,12-13H,11H2,1H3,(H3,24,25)(H2,26,31,32)(H,27,28,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	89	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human coagulation factor X				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50094098 (CHEMBL139124 | [3-(3-Carbamimidoyl-phenyl)-5-(4-ca...) Show SMILES CCOC(=O)CC1(CC(=NO1)c1cccc(c1)C(N)=N)C(=O)Nc1ccc(cc1)C(N)=N |c:8| Show InChI InChI=1S/C22H24N6O4/c1-2-31-18(29)12-22(21(30)27-16-8-6-13(7-9-16)19(23)24)11-17(28-32-22)14-4-3-5-15(10-14)20(25)26/h3-10H,2,11-12H2,1H3,(H3,23,24)(H3,25,26)(H,27,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	94	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human coagulation factor X				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50094108 (3-(2-Biphenyl-4-yl-2-oxo-ethyl)-3H-benzoimidazole-...) Show SMILES NC(=N)c1ccc2ncn(CC(=O)c3ccc(cc3)-c3ccccc3)c2c1 Show InChI InChI=1S/C22H18N4O/c23-22(24)18-10-11-19-20(12-18)26(14-25-19)13-21(27)17-8-6-16(7-9-17)15-4-2-1-3-5-15/h1-12,14H,13H2,(H3,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	120	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human coagulation factor X				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Serine protease 1 (Homo sapiens (Human))	BDBM50094091 (2-(5-Carbamimidoyl-1H-indol-3-yl)-N-(2'-methylsulf...) Show SMILES CNS(=O)(=O)c1ccccc1-c1ccc(NC(=O)Cc2c[nH]c3ccc(cc23)C(N)=N)cc1 Show InChI InChI=1S/C24H23N5O3S/c1-27-33(31,32)22-5-3-2-4-19(22)15-6-9-18(10-7-15)29-23(30)13-17-14-28-21-11-8-16(24(25)26)12-20(17)21/h2-12,14,27-28H,13H2,1H3,(H3,25,26)(H,29,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	120	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human trypsin				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Serine protease 1 (Homo sapiens (Human))	BDBM50094092 (CHEMBL336661 | N-(3-Bromo-2'-sulfamoyl-biphenyl-4-...) Show SMILES NC(=N)c1ccc2[nH]cc(CC(=O)Nc3ccc(cc3Br)-c3ccccc3S(N)(=O)=O)c2c1 Show InChI InChI=1S/C23H20BrN5O3S/c24-18-10-13(16-3-1-2-4-21(16)33(27,31)32)5-8-20(18)29-22(30)11-15-12-28-19-7-6-14(23(25)26)9-17(15)19/h1-10,12,28H,11H2,(H3,25,26)(H,29,30)(H2,27,31,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	120	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human trypsin				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Serine protease 1 (Homo sapiens (Human))	BDBM50094105 (2-(5-Carbamimidoyl-benzoimidazol-1-yl)-N-(2'-sulfa...) Show SMILES NC(=N)c1ccc2n(CC(=O)Nc3ccc(cc3)-c3ccccc3S(N)(=O)=O)cnc2c1 Show InChI InChI=1S/C22H20N6O3S/c23-22(24)15-7-10-19-18(11-15)26-13-28(19)12-21(29)27-16-8-5-14(6-9-16)17-3-1-2-4-20(17)32(25,30)31/h1-11,13H,12H2,(H3,23,24)(H,27,29)(H2,25,30,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	130	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human trypsin				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Serine protease 1 (Homo sapiens (Human))	BDBM50076545 (CHEMBL422722 | {1-[2-(4-Benzyl-piperidin-1-yl)-2-o...) Show SMILES COC(=O)Cc1cn(CC(=O)N2CCC(Cc3ccccc3)CC2)c2ccc(cc12)C(N)=N Show InChI InChI=1S/C26H30N4O3/c1-33-25(32)15-21-16-30(23-8-7-20(26(27)28)14-22(21)23)17-24(31)29-11-9-19(10-12-29)13-18-5-3-2-4-6-18/h2-8,14,16,19H,9-13,15,17H2,1H3,(H3,27,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	140	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibitory activity of the compound against trypsin				Bioorg Med Chem Lett 9: 925-30 (1999) BindingDB Entry DOI: 10.7270/Q2KS6QQ6
					More data for this Ligand-Target Pair
Serine protease 1 (Homo sapiens (Human))	BDBM50094096 (2-(5-Carbamimidoyl-1H-indol-3-yl)-N-(3-chloro-2'-s...) Show SMILES NC(=N)c1ccc2[nH]cc(CC(=O)Nc3ccc(cc3Cl)-c3ccccc3S(N)(=O)=O)c2c1 Show InChI InChI=1S/C23H20ClN5O3S/c24-18-10-13(16-3-1-2-4-21(16)33(27,31)32)5-8-20(18)29-22(30)11-15-12-28-19-7-6-14(23(25)26)9-17(15)19/h1-10,12,28H,11H2,(H3,25,26)(H,29,30)(H2,27,31,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	140	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human trypsin				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50076546 (1-[2-(4-Benzyl-piperidin-1-yl)-2-oxo-ethyl]-1H-ind...) Show SMILES NC(=N)c1ccc2n(CC(=O)N3CCC(Cc4ccccc4)CC3)ncc2c1 Show InChI InChI=1S/C22H25N5O/c23-22(24)18-6-7-20-19(13-18)14-25-27(20)15-21(28)26-10-8-17(9-11-26)12-16-4-2-1-3-5-16/h1-7,13-14,17H,8-12,15H2,(H3,23,24)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	140	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of Coagulation factor II				Bioorg Med Chem Lett 9: 925-30 (1999) BindingDB Entry DOI: 10.7270/Q2KS6QQ6
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50094099 (2-(5-Carbamimidoyl-benzoimidazol-1-ylmethyl)-4-(3-...) Show SMILES CCOC(=O)C(CCc1cccc(c1)C(N)=N)Cn1cnc2cc(ccc12)C(N)=N Show InChI InChI=1S/C22H26N6O2/c1-2-30-22(29)17(7-6-14-4-3-5-15(10-14)20(23)24)12-28-13-27-18-11-16(21(25)26)8-9-19(18)28/h3-5,8-11,13,17H,2,6-7,12H2,1H3,(H3,23,24)(H3,25,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	140	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human coagulation factor X				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Serine protease 1 (Homo sapiens (Human))	BDBM50094115 (2-(5-Carbamimidoyl-1H-indol-3-yl)-N-[5-(2-sulfamoy...) Show SMILES NC(=N)c1ccc2[nH]cc(CC(=O)Nc3ccc(cn3)-c3ccccc3S(N)(=O)=O)c2c1 Show InChI InChI=1S/C22H20N6O3S/c23-22(24)13-5-7-18-17(9-13)15(12-26-18)10-21(29)28-20-8-6-14(11-27-20)16-3-1-2-4-19(16)32(25,30)31/h1-9,11-12,26H,10H2,(H3,23,24)(H2,25,30,31)(H,27,28,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	150	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human trypsin				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Serine protease 1 (Homo sapiens (Human))	BDBM50094113 (2-(5-Carbamimidoyl-1H-indol-3-yl)-N-(2'-ethylsulfa...) Show SMILES CCNS(=O)(=O)c1ccccc1-c1ccc(NC(=O)Cc2c[nH]c3ccc(cc23)C(N)=N)cc1 Show InChI InChI=1S/C25H25N5O3S/c1-2-29-34(32,33)23-6-4-3-5-20(23)16-7-10-19(11-8-16)30-24(31)14-18-15-28-22-12-9-17(25(26)27)13-21(18)22/h3-13,15,28-29H,2,14H2,1H3,(H3,26,27)(H,30,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	160	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human trypsin				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Serine protease 1 (Homo sapiens (Human))	BDBM12775 (2-(5-carbamimidoyl-1H-indol-3-yl)-N-[4-(2-sulfamoy...) Show SMILES NC(=N)c1ccc2[nH]cc(CC(=O)Nc3ccc(cc3)-c3ccccc3S(N)(=O)=O)c2c1 Show InChI InChI=1S/C23H21N5O3S/c24-23(25)15-7-10-20-19(11-15)16(13-27-20)12-22(29)28-17-8-5-14(6-9-17)18-3-1-2-4-21(18)32(26,30)31/h1-11,13,27H,12H2,(H3,24,25)(H,28,29)(H2,26,30,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	160	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human trypsin				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Serine protease 1 (Homo sapiens (Human))	BDBM50094104 (2-(5-Carbamimidoyl-1H-indol-3-yl)-N-(2'-propylsulf...) Show SMILES CCCNS(=O)(=O)c1ccccc1-c1ccc(NC(=O)Cc2c[nH]c3ccc(cc23)C(N)=N)cc1 Show InChI InChI=1S/C26H27N5O3S/c1-2-13-30-35(33,34)24-6-4-3-5-21(24)17-7-10-20(11-8-17)31-25(32)15-19-16-29-23-12-9-18(26(27)28)14-22(19)23/h3-12,14,16,29-30H,2,13,15H2,1H3,(H3,27,28)(H,31,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	180	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human trypsin				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50094100 (2-(5-Carbamimidoyl-1H-indol-3-yl)-N-(3-iodo-2'-sul...) Show SMILES NC(=N)c1ccc2[nH]cc(CC(=O)Nc3ccc(cc3I)-c3ccccc3S(N)(=O)=O)c2c1 Show InChI InChI=1S/C23H20IN5O3S/c24-18-10-13(16-3-1-2-4-21(16)33(27,31)32)5-8-20(18)29-22(30)11-15-12-28-19-7-6-14(23(25)26)9-17(15)19/h1-10,12,28H,11H2,(H3,25,26)(H,29,30)(H2,27,31,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human thrombin				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50094092 (CHEMBL336661 | N-(3-Bromo-2'-sulfamoyl-biphenyl-4-...) Show SMILES NC(=N)c1ccc2[nH]cc(CC(=O)Nc3ccc(cc3Br)-c3ccccc3S(N)(=O)=O)c2c1 Show InChI InChI=1S/C23H20BrN5O3S/c24-18-10-13(16-3-1-2-4-21(16)33(27,31)32)5-8-20(18)29-22(30)11-15-12-28-19-7-6-14(23(25)26)9-17(15)19/h1-10,12,28H,11H2,(H3,25,26)(H,29,30)(H2,27,31,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human thrombin				J Med Chem 43: 4398-415 (2000) BindingDB Entry DOI: 10.7270/Q2JS9PP5
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50076542 (6-(4-Benzyl-piperidine-1-sulfonyl)-1H-indole-3-car...) Show SMILES NC(=N)c1c[nH]c2cc(ccc12)S(=O)(=O)N1CCC(Cc2ccccc2)CC1 Show InChI InChI=1S/C21H24N4O2S/c22-21(23)19-14-24-20-13-17(6-7-18(19)20)28(26,27)25-10-8-16(9-11-25)12-15-4-2-1-3-5-15/h1-7,13-14,16,24H,8-12H2,(H3,22,23)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	210	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of Coagulation factor II				Bioorg Med Chem Lett 9: 925-30 (1999) BindingDB Entry DOI: 10.7270/Q2KS6QQ6
					More data for this Ligand-Target Pair

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