Compile Data Set for Download or QSAR

Found 737 hits with Last Name = 'laws' and Initial = 'm'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Coagulation factor X (Homo sapiens (Human))	BDBM50374877 (CHEMBL270221) Show SMILES CN(C)CCN(C)C(=O)CN(C1CCCN(C1=O)c1ccc(cc1F)-n1ccccc1=O)S(=O)(=O)c1cc2ccc(Cl)nc2s1 |w:11.10| Show InChI InChI=1S/C30H32ClFN6O5S2/c1-34(2)15-16-35(3)27(40)19-38(45(42,43)28-17-20-9-12-25(31)33-29(20)44-28)24-7-6-14-37(30(24)41)23-11-10-21(18-22(23)32)36-13-5-4-8-26(36)39/h4-5,8-13,17-18,24H,6-7,14-16,19H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.0130	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374879 (CHEMBL401958) Show SMILES CN(C)CCN(C)C(=O)CN([C@H]1CCCN(C1=O)c1ccc(cc1F)-n1ccccc1=O)S(=O)(=O)c1ccc2cc(Cl)ccc2c1 Show InChI InChI=1S/C33H35ClFN5O5S/c1-36(2)17-18-37(3)32(42)22-40(46(44,45)27-13-10-23-19-25(34)11-9-24(23)20-27)30-7-6-16-39(33(30)43)29-14-12-26(21-28(29)35)38-15-5-4-8-31(38)41/h4-5,8-15,19-21,30H,6-7,16-18,22H2,1-3H3/t30-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.0160	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374878 (CHEMBL270862) Show SMILES Fc1cc(ccc1N1CCCC(NS(=O)(=O)c2cc3ccc(Cl)nc3s2)C1=O)-n1ccccc1=O |w:11.12| Show InChI InChI=1S/C23H18ClFN4O4S2/c24-19-9-6-14-12-21(34-22(14)26-19)35(32,33)27-17-4-3-11-29(23(17)31)18-8-7-15(13-16(18)25)28-10-2-1-5-20(28)30/h1-2,5-10,12-13,17,27H,3-4,11H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.0200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374879 (CHEMBL401958) Show SMILES CN(C)CCN(C)C(=O)CN([C@H]1CCCN(C1=O)c1ccc(cc1F)-n1ccccc1=O)S(=O)(=O)c1ccc2cc(Cl)ccc2c1 Show InChI InChI=1S/C33H35ClFN5O5S/c1-36(2)17-18-37(3)32(42)22-40(46(44,45)27-13-10-23-19-25(34)11-9-24(23)20-27)30-7-6-16-39(33(30)43)29-14-12-26(21-28(29)35)38-15-5-4-8-31(38)41/h4-5,8-15,19-21,30H,6-7,16-18,22H2,1-3H3/t30-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.0200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374876 (CHEMBL270034) Show SMILES CNC(=O)CN(C1CCCN(C1=O)c1ccc(cc1F)-n1ccccc1=O)S(=O)(=O)c1cc2ccc(Cl)nc2s1 |w:6.5| Show InChI InChI=1S/C26H23ClFN5O5S2/c1-29-22(34)15-33(40(37,38)24-13-16-7-10-21(27)30-25(16)39-24)20-5-4-12-32(26(20)36)19-9-8-17(14-18(19)28)31-11-3-2-6-23(31)35/h2-3,6-11,13-14,20H,4-5,12,15H2,1H3,(H,29,34)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.0370	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374871 (CHEMBL258274) Show SMILES COC(=O)CN(C1CCCN(C1=O)c1ccc(cc1)-n1ccccc1=O)S(=O)(=O)c1cc2ccc(Cl)nc2s1 |w:6.5| Show InChI InChI=1S/C26H23ClN4O6S2/c1-37-23(33)16-31(39(35,36)24-15-17-7-12-21(27)28-25(17)38-24)20-5-4-14-30(26(20)34)19-10-8-18(9-11-19)29-13-3-2-6-22(29)32/h2-3,6-13,15,20H,4-5,14,16H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.0430	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374875 (CHEMBL269955) Show SMILES Clc1ccc2cc(sc2n1)S(=O)(=O)NC1CCCN(C1=O)c1ccc(cc1)-n1ccccc1=O |w:14.15| Show InChI InChI=1S/C23H19ClN4O4S2/c24-19-11-6-15-14-21(33-22(15)25-19)34(31,32)26-18-4-3-13-28(23(18)30)17-9-7-16(8-10-17)27-12-2-1-5-20(27)29/h1-2,5-12,14,18,26H,3-4,13H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.0500	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374874 (CHEMBL256820) Show SMILES NC(=O)CN(C1CCCN(C1=O)c1ccc(cc1)-n1ccccc1=O)S(=O)(=O)c1cc2ccc(Cl)nc2s1 |w:5.4| Show InChI InChI=1S/C25H22ClN5O5S2/c26-20-11-6-16-14-23(37-24(16)28-20)38(35,36)31(15-21(27)32)19-4-3-13-30(25(19)34)18-9-7-17(8-10-18)29-12-2-1-5-22(29)33/h1-2,5-12,14,19H,3-4,13,15H2,(H2,27,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374880 (CHEMBL271904) Show SMILES Fc1cc(ccc1N1CCCC(NS(=O)(=O)c2ccc3cc(Cl)ccc3c2)C1=O)-n1ccccc1=O |w:11.12| Show InChI InChI=1S/C26H21ClFN3O4S/c27-19-8-6-18-15-21(10-7-17(18)14-19)36(34,35)29-23-4-3-13-31(26(23)33)24-11-9-20(16-22(24)28)30-12-2-1-5-25(30)32/h1-2,5-12,14-16,23,29H,3-4,13H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.110	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374873 (CHEMBL442457) Show SMILES OC(=O)CN(C1CCCN(C1=O)c1ccc(cc1)-n1ccccc1=O)S(=O)(=O)c1cc2ccc(Cl)nc2s1 |w:5.4| Show InChI InChI=1S/C25H21ClN4O6S2/c26-20-11-6-16-14-23(37-24(16)27-20)38(35,36)30(15-22(32)33)19-4-3-13-29(25(19)34)18-9-7-17(8-10-18)28-12-2-1-5-21(28)31/h1-2,5-12,14,19H,3-4,13,15H2,(H,32,33)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.130	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374885 (CHEMBL401788) Show SMILES COC(=O)CN(C1CCCN(C1=O)c1ccc(cc1F)-n1ccnc1C[N+](C)(C)CC(=O)OC)S(=O)(=O)c1ccc2cc(Cl)ccc2c1 |w:6.5| Show InChI InChI=1S/C33H36ClFN5O7S/c1-40(2,21-32(42)47-4)20-30-36-13-15-37(30)25-10-12-28(27(35)18-25)38-14-5-6-29(33(38)43)39(19-31(41)46-3)48(44,45)26-11-8-22-16-24(34)9-7-23(22)17-26/h7-13,15-18,29H,5-6,14,19-21H2,1-4H3/q+1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.210	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374886 (CHEMBL404119) Show SMILES COC(=O)C[N+](C)(C)Cc1nccn1-c1ccc(N2CCCC(NS(=O)(=O)c3ccc4cc(Cl)ccc4c3)C2=O)c(F)c1 |w:22.23| Show InChI InChI=1S/C30H32ClFN5O5S/c1-37(2,19-29(38)42-3)18-28-33-12-14-35(28)23-9-11-27(25(32)17-23)36-13-4-5-26(30(36)39)34-43(40,41)24-10-7-20-15-22(31)8-6-21(20)16-24/h6-12,14-17,26,34H,4-5,13,18-19H2,1-3H3/q+1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.350	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374889 (CHEMBL402828) Show SMILES CN(C1CCN(C)CC1)C(=O)N(C1CCCN(C1=O)c1ccc(cc1F)-c1ccccc1S(C)(=O)=O)S(=O)(=O)c1ccc2cc(Cl)ccc2c1 |w:12.12| Show InChI InChI=1S/C36H38ClFN4O6S2/c1-39-19-16-28(17-20-39)40(2)36(44)42(50(47,48)29-14-11-24-21-27(37)13-10-25(24)22-29)33-8-6-18-41(35(33)43)32-15-12-26(23-31(32)38)30-7-4-5-9-34(30)49(3,45)46/h4-5,7,9-15,21-23,28,33H,6,8,16-20H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.430	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374888 (CHEMBL272136) Show SMILES CN1CCN(CC1)C(=O)N(C1CCCN(C1=O)c1ccc(cc1F)-c1ccccc1S(C)(=O)=O)S(=O)(=O)c1ccc2cc(Cl)ccc2c1 |w:10.10| Show InChI InChI=1S/C34H34ClFN4O6S2/c1-37-16-18-38(19-17-37)34(42)40(48(45,46)27-13-10-23-20-26(35)12-9-24(23)21-27)31-7-5-15-39(33(31)41)30-14-11-25(22-29(30)36)28-6-3-4-8-32(28)47(2,43)44/h3-4,6,8-14,20-22,31H,5,7,15-19H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.710	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374892 (CHEMBL256628) Show SMILES CN(C)CCN(C)C(=O)N(C1CCCN(C1=O)c1ccc(cc1F)-c1ccccc1S(C)(=O)=O)S(=O)(=O)c1ccc2cc(Cl)ccc2c1 |w:10.9| Show InChI InChI=1S/C34H36ClFN4O6S2/c1-37(2)18-19-38(3)34(42)40(48(45,46)27-15-12-23-20-26(35)14-11-24(23)21-27)31-9-7-17-39(33(31)41)30-16-13-25(22-29(30)36)28-8-5-6-10-32(28)47(4,43)44/h5-6,8,10-16,20-22,31H,7,9,17-19H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.840	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374895 (CHEMBL408044) Show SMILES COC(=O)CN(C1CCCN(C1=O)c1ccc(cc1F)-c1ccccc1S(C)(=O)=O)S(=O)(=O)c1ccc2cc(Cl)ccc2c1 |w:6.5| Show InChI InChI=1S/C31H28ClFN2O7S2/c1-42-30(36)19-35(44(40,41)24-13-10-20-16-23(32)12-9-21(20)17-24)28-7-5-15-34(31(28)37)27-14-11-22(18-26(27)33)25-6-3-4-8-29(25)43(2,38)39/h3-4,6,8-14,16-18,28H,5,7,15,19H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.880	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374896 (CHEMBL271427) Show SMILES CS(=O)(=O)c1ccccc1-c1ccc(N2CCCC(N(CC(O)=O)S(=O)(=O)c3ccc4cc(Cl)ccc4c3)C2=O)c(F)c1 |w:18.19| Show InChI InChI=1S/C30H26ClFN2O7S2/c1-42(38,39)28-7-3-2-5-24(28)21-10-13-26(25(32)17-21)33-14-4-6-27(30(33)37)34(18-29(35)36)43(40,41)23-12-9-19-15-22(31)11-8-20(19)16-23/h2-3,5,7-13,15-17,27H,4,6,14,18H2,1H3,(H,35,36)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374891 (CHEMBL270829) Show SMILES CCN(CC)CCN(C)C(=O)N(C1CCCN(C1=O)c1ccc(cc1F)-c1ccccc1S(C)(=O)=O)S(=O)(=O)c1ccc2cc(Cl)ccc2c1 |w:12.11| Show InChI InChI=1S/C36H40ClFN4O6S2/c1-5-40(6-2)21-20-39(3)36(44)42(50(47,48)29-17-14-25-22-28(37)16-13-26(25)23-29)33-11-9-19-41(35(33)43)32-18-15-27(24-31(32)38)30-10-7-8-12-34(30)49(4,45)46/h7-8,10,12-18,22-24,33H,5-6,9,11,19-21H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374881 (CHEMBL270565) Show SMILES CN(C)CCN(C)C(=O)CN(C1CCCN(C1=O)c1ccc(cc1F)N1CCCCC1=O)S(=O)(=O)c1ccc2cc(Cl)ccc2c1 |w:11.10| Show InChI InChI=1S/C33H39ClFN5O5S/c1-36(2)17-18-37(3)32(42)22-40(46(44,45)27-13-10-23-19-25(34)11-9-24(23)20-27)30-7-6-16-39(33(30)43)29-14-12-26(21-28(29)35)38-15-5-4-8-31(38)41/h9-14,19-21,30H,4-8,15-18,22H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374917 (CHEMBL403106) Show SMILES CS(=O)(=O)c1ccccc1-c1ccc(N2CCCC(NS(=O)(=O)c3cccc4cc(Cl)ccc34)C2=O)c(F)c1 |w:18.19| Show InChI InChI=1S/C28H24ClFN2O5S2/c1-38(34,35)26-9-3-2-7-21(26)19-11-14-25(23(30)17-19)32-15-5-8-24(28(32)33)31-39(36,37)27-10-4-6-18-16-20(29)12-13-22(18)27/h2-4,6-7,9-14,16-17,24,31H,5,8,15H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374893 (CHEMBL270255) Show SMILES CN(C)CCNC(=O)N(C1CCCN(C1=O)c1ccc(cc1F)-c1ccccc1S(C)(=O)=O)S(=O)(=O)c1ccc2cc(Cl)ccc2c1 |w:9.8| Show InChI InChI=1S/C33H34ClFN4O6S2/c1-37(2)18-16-36-33(41)39(47(44,45)26-14-11-22-19-25(34)13-10-23(22)20-26)30-8-6-17-38(32(30)40)29-15-12-24(21-28(29)35)27-7-4-5-9-31(27)46(3,42)43/h4-5,7,9-15,19-21,30H,6,8,16-18H2,1-3H3,(H,36,41)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374894 (CHEMBL256890) Show SMILES CS(=O)(=O)c1ccccc1-c1ccc(N2CCCC(N(CCCO)S(=O)(=O)c3ccc4cc(Cl)ccc4c3)C2=O)c(F)c1 |w:18.19| Show InChI InChI=1S/C31H30ClFN2O6S2/c1-42(38,39)30-8-3-2-6-26(30)23-11-14-28(27(33)20-23)34-15-4-7-29(31(34)37)35(16-5-17-36)43(40,41)25-13-10-21-18-24(32)12-9-22(21)19-25/h2-3,6,8-14,18-20,29,36H,4-5,7,15-17H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374887 (CHEMBL272349) Show SMILES CN(C)Cc1nccn1-c1ccc(N2CCCC(NS(=O)(=O)c3ccc4cc(Cl)ccc4c3)C2=O)c(F)c1 |w:17.18| Show InChI InChI=1S/C27H27ClFN5O3S/c1-32(2)17-26-30-11-13-33(26)21-8-10-25(23(29)16-21)34-12-3-4-24(27(34)35)31-38(36,37)22-9-6-18-14-20(28)7-5-19(18)15-22/h5-11,13-16,24,31H,3-4,12,17H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374890 (CHEMBL257854) Show SMILES CN(CCO)C(=O)N(C1CCCN(C1=O)c1ccc(cc1F)-c1ccccc1S(C)(=O)=O)S(=O)(=O)c1ccc2cc(Cl)ccc2c1 |w:8.7| Show InChI InChI=1S/C32H31ClFN3O7S2/c1-35(16-17-38)32(40)37(46(43,44)25-13-10-21-18-24(33)12-9-22(21)19-25)29-7-5-15-36(31(29)39)28-14-11-23(20-27(28)34)26-6-3-4-8-30(26)45(2,41)42/h3-4,6,8-14,18-20,29,38H,5,7,15-17H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Transporter (Rattus norvegicus (rat))	BDBM84745 (CAS_136434-34-9 | DULOXETINE | LY-248686 | LY24868...) Show SMILES CNCC[C@H](Oc1cccc2ccccc12)c1cccs1 |r| Show InChI InChI=1S/C18H19NOS/c1-19-12-11-17(18-10-5-13-21-18)20-16-9-4-7-14-6-2-3-8-15(14)16/h2-10,13,17,19H,11-12H2,1H3/t17-/m0/s1	Reactome pathway UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	3.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of rat NET				Bioorg Med Chem Lett 22: 7219-22 (2012) Article DOI: 10.1016/j.bmcl.2012.09.050 BindingDB Entry DOI: 10.7270/Q20K29QC
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50401743 (CHEMBL2206526) Show SMILES CN1CC(c2ccc(C)c(F)c2)c2ccccc2C1 Show InChI InChI=1S/C17H18FN/c1-12-7-8-13(9-17(12)18)16-11-19(2)10-14-5-3-4-6-15(14)16/h3-9,16H,10-11H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human NET				Bioorg Med Chem Lett 22: 7219-22 (2012) Article DOI: 10.1016/j.bmcl.2012.09.050 BindingDB Entry DOI: 10.7270/Q20K29QC
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50401732 (CHEMBL2206507) Show SMILES CN1CC(c2cccc(Cl)c2)c2ccc(C)cc2C1 Show InChI InChI=1S/C17H18ClN/c1-12-6-7-16-14(8-12)10-19(2)11-17(16)13-4-3-5-15(18)9-13/h3-9,17H,10-11H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human NET				Bioorg Med Chem Lett 22: 7219-22 (2012) Article DOI: 10.1016/j.bmcl.2012.09.050 BindingDB Entry DOI: 10.7270/Q20K29QC
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374900 (CHEMBL402064) Show SMILES CS(=O)(=O)c1ccccc1-c1ccc(N2CCCC(NS(=O)(=O)c3ccc(Cl)s3)C2=O)c(F)c1 |w:18.19| Show InChI InChI=1S/C22H20ClFN2O5S3/c1-33(28,29)19-7-3-2-5-15(19)14-8-9-18(16(24)13-14)26-12-4-6-17(22(26)27)25-34(30,31)21-11-10-20(23)32-21/h2-3,5,7-11,13,17,25H,4,6,12H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	5.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50401731 (CHEMBL2206508) Show SMILES CN1CC(c2cc(F)cc(F)c2)c2ccc(C)cc2C1 Show InChI InChI=1S/C17H17F2N/c1-11-3-4-16-13(5-11)9-20(2)10-17(16)12-6-14(18)8-15(19)7-12/h3-8,17H,9-10H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human NET				Bioorg Med Chem Lett 22: 7219-22 (2012) Article DOI: 10.1016/j.bmcl.2012.09.050 BindingDB Entry DOI: 10.7270/Q20K29QC
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM84745 (CAS_136434-34-9 | DULOXETINE | LY-248686 | LY24868...) Show SMILES CNCC[C@H](Oc1cccc2ccccc12)c1cccs1 |r| Show InChI InChI=1S/C18H19NOS/c1-19-12-11-17(18-10-5-13-21-18)20-16-9-4-7-14-6-2-3-8-15(14)16/h2-10,13,17,19H,11-12H2,1H3/t17-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	DrugBank Article PubMed	5.97	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human NET				Bioorg Med Chem Lett 22: 7219-22 (2012) Article DOI: 10.1016/j.bmcl.2012.09.050 BindingDB Entry DOI: 10.7270/Q20K29QC
					More data for this Ligand-Target Pair
Transporter (Rattus norvegicus (rat))	BDBM50401730 (CHEMBL2206509) Show SMILES CN1C[C@@H](c2ccc(F)cc2)c2ccc(C)cc2C1 |r| Show InChI InChI=1S/C17H18FN/c1-12-3-8-16-14(9-12)10-19(2)11-17(16)13-4-6-15(18)7-5-13/h3-9,17H,10-11H2,1-2H3/t17-/m0/s1	Reactome pathway UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of rat NET				Bioorg Med Chem Lett 22: 7219-22 (2012) Article DOI: 10.1016/j.bmcl.2012.09.050 BindingDB Entry DOI: 10.7270/Q20K29QC
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50401730 (CHEMBL2206509) Show SMILES CN1C[C@@H](c2ccc(F)cc2)c2ccc(C)cc2C1 |r| Show InChI InChI=1S/C17H18FN/c1-12-3-8-16-14(9-12)10-19(2)11-17(16)13-4-6-15(18)7-5-13/h3-9,17H,10-11H2,1-2H3/t17-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human NET				Bioorg Med Chem Lett 22: 7219-22 (2012) Article DOI: 10.1016/j.bmcl.2012.09.050 BindingDB Entry DOI: 10.7270/Q20K29QC
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50401744 (CHEMBL2206525) Show SMILES CN1CC(c2ccc(Cl)c(F)c2)c2ccccc2C1 Show InChI InChI=1S/C16H15ClFN/c1-19-9-12-4-2-3-5-13(12)14(10-19)11-6-7-15(17)16(18)8-11/h2-8,14H,9-10H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human NET				Bioorg Med Chem Lett 22: 7219-22 (2012) Article DOI: 10.1016/j.bmcl.2012.09.050 BindingDB Entry DOI: 10.7270/Q20K29QC
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50401737 (CHEMBL2206532) Show SMILES COc1ccc2C(CN(C)Cc2c1)c1cccc(C)c1 Show InChI InChI=1S/C18H21NO/c1-13-5-4-6-14(9-13)18-12-19(2)11-15-10-16(20-3)7-8-17(15)18/h4-10,18H,11-12H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human NET				Bioorg Med Chem Lett 22: 7219-22 (2012) Article DOI: 10.1016/j.bmcl.2012.09.050 BindingDB Entry DOI: 10.7270/Q20K29QC
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50401738 (CHEMBL2206531) Show SMILES COc1ccc2C(CN(C)Cc2c1)c1ccc(F)c(F)c1 Show InChI InChI=1S/C17H17F2NO/c1-20-9-12-7-13(21-2)4-5-14(12)15(10-20)11-3-6-16(18)17(19)8-11/h3-8,15H,9-10H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human NET				Bioorg Med Chem Lett 22: 7219-22 (2012) Article DOI: 10.1016/j.bmcl.2012.09.050 BindingDB Entry DOI: 10.7270/Q20K29QC
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374882 (CHEMBL257037) Show SMILES Fc1cc(ccc1N1CCCC(NS(=O)(=O)c2ccc3cc(Cl)ccc3c2)C1=O)N1CCCCC1=O |w:11.12| Show InChI InChI=1S/C26H25ClFN3O4S/c27-19-8-6-18-15-21(10-7-17(18)14-19)36(34,35)29-23-4-3-13-31(26(23)33)24-11-9-20(16-22(24)28)30-12-2-1-5-25(30)32/h6-11,14-16,23,29H,1-5,12-13H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50401740 (CHEMBL2206529) Show SMILES CN1CC(c2ccc(C)cc2)c2cccc(C)c2C1 Show InChI InChI=1S/C18H21N/c1-13-7-9-15(10-8-13)18-12-19(3)11-17-14(2)5-4-6-16(17)18/h4-10,18H,11-12H2,1-3H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	10.6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of DAT				Bioorg Med Chem Lett 22: 7219-22 (2012) Article DOI: 10.1016/j.bmcl.2012.09.050 BindingDB Entry DOI: 10.7270/Q20K29QC
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50401716 (CHEMBL2206524) Show SMILES CN1CC(c2ccc(F)c(F)c2)c2ccccc2C1 Show InChI InChI=1S/C16H15F2N/c1-19-9-12-4-2-3-5-13(12)14(10-19)11-6-7-15(17)16(18)8-11/h2-8,14H,9-10H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	12.3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human NET				Bioorg Med Chem Lett 22: 7219-22 (2012) Article DOI: 10.1016/j.bmcl.2012.09.050 BindingDB Entry DOI: 10.7270/Q20K29QC
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50401735 (CHEMBL2206534) Show SMILES CN1CC(c2ccc(F)c(F)c2)c2ccc(O)cc2C1 Show InChI InChI=1S/C16H15F2NO/c1-19-8-11-6-12(20)3-4-13(11)14(9-19)10-2-5-15(17)16(18)7-10/h2-7,14,20H,8-9H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human NET				Bioorg Med Chem Lett 22: 7219-22 (2012) Article DOI: 10.1016/j.bmcl.2012.09.050 BindingDB Entry DOI: 10.7270/Q20K29QC
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50401742 (CHEMBL2206527) Show SMILES CN1CC(c2ccc(F)c(C)c2)c2ccccc2C1 Show InChI InChI=1S/C17H18FN/c1-12-9-13(7-8-17(12)18)16-11-19(2)10-14-5-3-4-6-15(14)16/h3-9,16H,10-11H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	13.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human NET				Bioorg Med Chem Lett 22: 7219-22 (2012) Article DOI: 10.1016/j.bmcl.2012.09.050 BindingDB Entry DOI: 10.7270/Q20K29QC
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50401733 (CHEMBL2206536) Show SMILES CN1CC(c2ccc(F)c(F)c2)c2ccc(C)cc2C1 Show InChI InChI=1S/C17H17F2N/c1-11-3-5-14-13(7-11)9-20(2)10-15(14)12-4-6-16(18)17(19)8-12/h3-8,15H,9-10H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	14	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human NET				Bioorg Med Chem Lett 22: 7219-22 (2012) Article DOI: 10.1016/j.bmcl.2012.09.050 BindingDB Entry DOI: 10.7270/Q20K29QC
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50401734 (CHEMBL2206535) Show SMILES CN1CC(c2ccc(C)cc2)c2ccc(C)cc2C1 Show InChI InChI=1S/C18H21N/c1-13-4-7-15(8-5-13)18-12-19(3)11-16-10-14(2)6-9-17(16)18/h4-10,18H,11-12H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human NET				Bioorg Med Chem Lett 22: 7219-22 (2012) Article DOI: 10.1016/j.bmcl.2012.09.050 BindingDB Entry DOI: 10.7270/Q20K29QC
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374883 (CHEMBL429741) Show SMILES Fc1cc(ccc1N1CCCC(NS(=O)(=O)c2ccc3cc(Cl)ccc3c2)C1=O)N1CCCCC1 |w:11.12| Show InChI InChI=1S/C26H27ClFN3O3S/c27-20-8-6-19-16-22(10-7-18(19)15-20)35(33,34)29-24-5-4-14-31(26(24)32)25-11-9-21(17-23(25)28)30-12-2-1-3-13-30/h6-11,15-17,24,29H,1-5,12-14H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50401736 (CHEMBL2206533) Show SMILES COc1ccc2C(CN(C)Cc2c1)c1ccc(C)c(F)c1 Show InChI InChI=1S/C18H20FNO/c1-12-4-5-13(9-18(12)19)17-11-20(2)10-14-8-15(21-3)6-7-16(14)17/h4-9,17H,10-11H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	16.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human NET				Bioorg Med Chem Lett 22: 7219-22 (2012) Article DOI: 10.1016/j.bmcl.2012.09.050 BindingDB Entry DOI: 10.7270/Q20K29QC
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374902 (CHEMBL402237) Show SMILES CS(=O)(=O)c1ccccc1-c1ccc(N2CCCC(NS(=O)(=O)c3cccc4ccc(Cl)cc34)C2=O)c(F)c1 |w:18.19| Show InChI InChI=1S/C28H24ClFN2O5S2/c1-38(34,35)26-9-3-2-7-21(26)19-12-14-25(23(30)16-19)32-15-5-8-24(28(32)33)31-39(36,37)27-10-4-6-18-11-13-20(29)17-22(18)27/h2-4,6-7,9-14,16-17,24,31H,5,8,15H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	18	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374901 (CHEMBL255799) Show SMILES CS(=O)(=O)c1ccccc1-c1ccc(N2CCCC(NS(=O)(=O)c3ccc4onc(N)c4c3)C2=O)c(F)c1 |w:18.19| Show InChI InChI=1S/C25H23FN4O6S2/c1-37(32,33)23-7-3-2-5-17(23)15-8-10-21(19(26)13-15)30-12-4-6-20(25(30)31)29-38(34,35)16-9-11-22-18(14-16)24(27)28-36-22/h2-3,5,7-11,13-14,20,29H,4,6,12H2,1H3,(H2,27,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	19	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50401740 (CHEMBL2206529) Show SMILES CN1CC(c2ccc(C)cc2)c2cccc(C)c2C1 Show InChI InChI=1S/C18H21N/c1-13-7-9-15(10-8-13)18-12-19(3)11-17-14(2)5-4-6-16(17)18/h4-10,18H,11-12H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	19	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human NET				Bioorg Med Chem Lett 22: 7219-22 (2012) Article DOI: 10.1016/j.bmcl.2012.09.050 BindingDB Entry DOI: 10.7270/Q20K29QC
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50374898 (CHEMBL429758) Show SMILES CS(=O)(=O)c1ccccc1-c1ccc(N2CCCC(NS(=O)(=O)c3ccc4cn[nH]c4c3)C2=O)c(F)c1 |w:18.19| Show InChI InChI=1S/C25H23FN4O5S2/c1-36(32,33)24-7-3-2-5-19(24)16-9-11-23(20(26)13-16)30-12-4-6-21(25(30)31)29-37(34,35)18-10-8-17-15-27-28-22(17)14-18/h2-3,5,7-11,13-15,21,29H,4,6,12H2,1H3,(H,27,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	19	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 2428-33 (2008) Article DOI: 10.1016/j.bmcl.2008.02.054 BindingDB Entry DOI: 10.7270/Q2RX9CZ8
					More data for this Ligand-Target Pair
Transporter (Rattus norvegicus (rat))	BDBM50005548 ((+)-2-Methyl-4-phenyl-1,2,3,4-tetrahydro-isoquinol...) Show SMILES CN1CC(c2ccccc2)c2cccc(N)c2C1 Show InChI InChI=1S/C16H18N2/c1-18-10-14(12-6-3-2-4-7-12)13-8-5-9-16(17)15(13)11-18/h2-9,14H,10-11,17H2,1H3	Reactome pathway UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid UniChem Patents Similars	Article PubMed	20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of rat NET				Bioorg Med Chem Lett 22: 7219-22 (2012) Article DOI: 10.1016/j.bmcl.2012.09.050 BindingDB Entry DOI: 10.7270/Q20K29QC
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50401736 (CHEMBL2206533) Show SMILES COc1ccc2C(CN(C)Cc2c1)c1ccc(C)c(F)c1 Show InChI InChI=1S/C18H20FNO/c1-12-4-5-13(9-18(12)19)17-11-20(2)10-14-8-15(21-3)6-7-16(14)17/h4-9,17H,10-11H2,1-3H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	21.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of DAT				Bioorg Med Chem Lett 22: 7219-22 (2012) Article DOI: 10.1016/j.bmcl.2012.09.050 BindingDB Entry DOI: 10.7270/Q20K29QC
					More data for this Ligand-Target Pair

Displayed 1 to 50 (of 737 total )  |  Next  |  Last  >>

Jump to: