Compile Data Set for Download or QSAR

Found 131 hits with Last Name = 'schmidt' and Initial = 'jb'   

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
Potassium voltage-gated channel subfamily KQT member 1 (Cavia porcellus)	BDBM50106179 (CHEMBL125327 | Enantiomer-4-(3-Butyl-[1,2,4]oxadia...) Show SMILES CCCCc1noc(n1)-c1ccc(cc1)C(=O)NC[C@H]1CCCC1(C)C Show InChI InChI=1S/C21H29N3O2/c1-4-5-8-18-23-20(26-24-18)16-11-9-15(10-12-16)19(25)22-14-17-7-6-13-21(17,2)3/h9-12,17H,4-8,13-14H2,1-3H3,(H,22,25)/t17-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Molar concentration required to inhibit 50% of the activating delayed-rectifier K+ current in isolated guinea pig ventricularmyocytes				J Med Chem 44: 3764-7 (2001) BindingDB Entry DOI: 10.7270/Q2G1604C
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 1 (Cavia porcellus)	BDBM50106169 (CHEMBL338973 | Enantiomer-4-(3-Butyl-[1,2,4]oxadia...) Show SMILES CCCCc1noc(n1)-c1ccc(cc1)C(=O)NC[C@@H]1CCCC1(C)C Show InChI InChI=1S/C21H29N3O2/c1-4-5-8-18-23-20(26-24-18)16-11-9-15(10-12-16)19(25)22-14-17-7-6-13-21(17,2)3/h9-12,17H,4-8,13-14H2,1-3H3,(H,22,25)/t17-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Molar concentration required to inhibit 50% of the activating delayed-rectifier K+ current in isolated guinea pig ventricularmyocytes				J Med Chem 44: 3764-7 (2001) BindingDB Entry DOI: 10.7270/Q2G1604C
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 1 (Cavia porcellus)	BDBM50106167 (CHEMBL125000 | Enantiomer-4-(3-Cyclopropylmethyl-[...) Show SMILES CC1(C)CCCC1CNC(=O)c1ccc(cc1)-c1nc(CC2CC2)no1 Show InChI InChI=1S/C21H27N3O2/c1-21(2)11-3-4-17(21)13-22-19(25)15-7-9-16(10-8-15)20-23-18(24-26-20)12-14-5-6-14/h7-10,14,17H,3-6,11-13H2,1-2H3,(H,22,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Molar concentration required to inhibit 50% of the activating delayed-rectifier K+ current in isolated guinea pig ventricularmyocytes				J Med Chem 44: 3764-7 (2001) BindingDB Entry DOI: 10.7270/Q2G1604C
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 1 (Cavia porcellus)	BDBM50106167 (CHEMBL125000 | Enantiomer-4-(3-Cyclopropylmethyl-[...) Show SMILES CC1(C)CCCC1CNC(=O)c1ccc(cc1)-c1nc(CC2CC2)no1 Show InChI InChI=1S/C21H27N3O2/c1-21(2)11-3-4-17(21)13-22-19(25)15-7-9-16(10-8-15)20-23-18(24-26-20)12-14-5-6-14/h7-10,14,17H,3-6,11-13H2,1-2H3,(H,22,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bindind affinity value obtained by measuring the displacement of radioligand [3H]-(-)-cytisine from whole rat brain Nicotinic acetylcholine receptor				J Med Chem 44: 3764-7 (2001) BindingDB Entry DOI: 10.7270/Q2G1604C
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 1 (Cavia porcellus)	BDBM50106178 (4-(3-Butyl-[1,2,4]oxadiazol-5-yl)-N-(3,3-dimethyl-...) Show SMILES CCCCc1noc(n1)-c1ccc(cc1)C(=O)NCCC(C)(C)C Show InChI InChI=1S/C19H27N3O2/c1-5-6-7-16-21-18(24-22-16)15-10-8-14(9-11-15)17(23)20-13-12-19(2,3)4/h8-11H,5-7,12-13H2,1-4H3,(H,20,23)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Molar concentration required to inhibit 50% of the activating delayed-rectifier K+ current in isolated guinea pig ventricularmyocytes				J Med Chem 44: 3764-7 (2001) BindingDB Entry DOI: 10.7270/Q2G1604C
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 1 (Cavia porcellus)	BDBM50106168 (CHEMBL124448 | Enantiomer-N-(2,2-Dimethyl-cyclopen...) Show SMILES CCCc1noc(n1)-c1ccc(cc1)C(=O)NCC1CCCC1(C)C Show InChI InChI=1S/C20H27N3O2/c1-4-6-17-22-19(25-23-17)15-10-8-14(9-11-15)18(24)21-13-16-7-5-12-20(16,2)3/h8-11,16H,4-7,12-13H2,1-3H3,(H,21,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	27	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bindind affinity value obtained by measuring the displacement of radioligand [3H]-(-)-cytisine from whole rat brain Nicotinic acetylcholine receptor				J Med Chem 44: 3764-7 (2001) BindingDB Entry DOI: 10.7270/Q2G1604C
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 1 (Cavia porcellus)	BDBM50106168 (CHEMBL124448 | Enantiomer-N-(2,2-Dimethyl-cyclopen...) Show SMILES CCCc1noc(n1)-c1ccc(cc1)C(=O)NCC1CCCC1(C)C Show InChI InChI=1S/C20H27N3O2/c1-4-6-17-22-19(25-23-17)15-10-8-14(9-11-15)18(24)21-13-16-7-5-12-20(16,2)3/h8-11,16H,4-7,12-13H2,1-3H3,(H,21,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	27	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Molar concentration required to inhibit 50% of the activating delayed-rectifier K+ current in isolated guinea pig ventricularmyocytes				J Med Chem 44: 3764-7 (2001) BindingDB Entry DOI: 10.7270/Q2G1604C
					More data for this Ligand-Target Pair
ATP synthase subunit beta,/delta,/epsilon,/gamma, mitochondrial (Bos taurus)	BDBM50404297 (CHEMBL269080) Show SMILES Clc1ccc(NC(=S)OC(Cn2ccnc2)c2ccc(Cl)cc2Cl)c(Cl)c1 Show InChI InChI=1S/C18H13Cl4N3OS/c19-11-1-3-13(14(21)7-11)17(9-25-6-5-23-10-25)26-18(27)24-16-4-2-12(20)8-15(16)22/h1-8,10,17H,9H2,(H,24,27)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibitory activity against bovine mitochondrial F1F0 ATP hydrolase				Bioorg Med Chem Lett 14: 1027-30 (2004) Article DOI: 10.1016/j.bmcl.2003.11.077 BindingDB Entry DOI: 10.7270/Q2VX0HQ9
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 1 (Cavia porcellus)	BDBM50061218 ((E)-3-(2,4-Dichloro-phenyl)-N-((R)-1-methyl-2-oxo-...) Show SMILES CN1c2ccccc2C(=N[C@@H](NC(=O)\C=C\c2ccc(Cl)cc2Cl)C1=O)c1ccccc1 |c:9| Show InChI InChI=1S/C25H19Cl2N3O2/c1-30-21-10-6-5-9-19(21)23(17-7-3-2-4-8-17)29-24(25(30)32)28-22(31)14-12-16-11-13-18(26)15-20(16)27/h2-15,24H,1H3,(H,28,31)/b14-12+/t24-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	31	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Molar concentration required to inhibit 50% of the activating delayed-rectifier K+ current in isolated guinea pig ventricularmyocytes				J Med Chem 44: 3764-7 (2001) BindingDB Entry DOI: 10.7270/Q2G1604C
					More data for this Ligand-Target Pair
ATP synthase subunit beta,/delta,/epsilon,/gamma, mitochondrial (Bos taurus)	BDBM50404288 (CHEMBL269369) Show SMILES OC(C(Nc1ccc(Cl)cc1)=NC(Cn1ccnc1)c1ccc(Cl)cc1Cl)c1cccc(c1)C#N |w:11.12| Show InChI InChI=1S/C26H20Cl3N5O/c27-19-4-7-21(8-5-19)32-26(25(35)18-3-1-2-17(12-18)14-30)33-24(15-34-11-10-31-16-34)22-9-6-20(28)13-23(22)29/h1-13,16,24-25,35H,15H2,(H,32,33)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	33	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibitory activity against bovine mitochondrial F1F0-ATP synthase				Bioorg Med Chem Lett 14: 1027-30 (2004) Article DOI: 10.1016/j.bmcl.2003.11.077 BindingDB Entry DOI: 10.7270/Q2VX0HQ9
					More data for this Ligand-Target Pair
ATP synthase subunit beta,/delta,/epsilon,/gamma, mitochondrial (Bos taurus)	BDBM50404288 (CHEMBL269369) Show SMILES OC(C(Nc1ccc(Cl)cc1)=NC(Cn1ccnc1)c1ccc(Cl)cc1Cl)c1cccc(c1)C#N |w:11.12| Show InChI InChI=1S/C26H20Cl3N5O/c27-19-4-7-21(8-5-19)32-26(25(35)18-3-1-2-17(12-18)14-30)33-24(15-34-11-10-31-16-34)22-9-6-20(28)13-23(22)29/h1-13,16,24-25,35H,15H2,(H,32,33)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	33	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibitory activity against bovine mitochondrial F1F0 ATP hydrolase				Bioorg Med Chem Lett 14: 1027-30 (2004) Article DOI: 10.1016/j.bmcl.2003.11.077 BindingDB Entry DOI: 10.7270/Q2VX0HQ9
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 1 (Cavia porcellus)	BDBM50106176 (CHEMBL340681 | Enantiomer-N-(2,2-Dimethyl-cyclopen...) Show SMILES CC1(C)CCCC1CNC(=O)c1ccc(cc1)-c1noc(CCC(F)(F)F)n1 Show InChI InChI=1S/C20H24F3N3O2/c1-19(2)10-3-4-15(19)12-24-18(27)14-7-5-13(6-8-14)17-25-16(28-26-17)9-11-20(21,22)23/h5-8,15H,3-4,9-12H2,1-2H3,(H,24,27)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bindind affinity values obtained by measuring the displacement of radioligand [3H]-(-)-cytisine from a preparation of whole rat brain				J Med Chem 44: 3764-7 (2001) BindingDB Entry DOI: 10.7270/Q2G1604C
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 1 (Cavia porcellus)	BDBM50106176 (CHEMBL340681 | Enantiomer-N-(2,2-Dimethyl-cyclopen...) Show SMILES CC1(C)CCCC1CNC(=O)c1ccc(cc1)-c1noc(CCC(F)(F)F)n1 Show InChI InChI=1S/C20H24F3N3O2/c1-19(2)10-3-4-15(19)12-24-18(27)14-7-5-13(6-8-14)17-25-16(28-26-17)9-11-20(21,22)23/h5-8,15H,3-4,9-12H2,1-2H3,(H,24,27)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Molar concentration required to inhibit 50% of the activating delayed-rectifier K+ current in isolated guinea pig ventricularmyocytes				J Med Chem 44: 3764-7 (2001) BindingDB Entry DOI: 10.7270/Q2G1604C
					More data for this Ligand-Target Pair
ATP synthase subunit beta,/delta,/epsilon,/gamma, mitochondrial (Bos taurus)	BDBM50404293 (CHEMBL8024) Show SMILES OC(C(Nc1ccc(Cl)cc1)=NC(Cn1ccnc1)c1ccc(Cl)cc1Cl)c1ccc(Cl)cc1 |w:11.12| Show InChI InChI=1S/C25H20Cl4N4O/c26-17-3-1-16(2-4-17)24(34)25(31-20-8-5-18(27)6-9-20)32-23(14-33-12-11-30-15-33)21-10-7-19(28)13-22(21)29/h1-13,15,23-24,34H,14H2,(H,31,32)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	82	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibitory activity against bovine mitochondrial F1F0 ATP hydrolase				Bioorg Med Chem Lett 14: 1027-30 (2004) Article DOI: 10.1016/j.bmcl.2003.11.077 BindingDB Entry DOI: 10.7270/Q2VX0HQ9
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 1 (Cavia porcellus)	BDBM50106182 (CHEMBL123085 | N-(3,3-Dimethyl-butyl)-4-(3-phenyl-...) Show SMILES CC(C)(C)CCNC(=O)c1ccc(cc1)-c1nc(no1)-c1ccccc1 Show InChI InChI=1S/C21H23N3O2/c1-21(2,3)13-14-22-19(25)16-9-11-17(12-10-16)20-23-18(24-26-20)15-7-5-4-6-8-15/h4-12H,13-14H2,1-3H3,(H,22,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Molar concentration required to inhibit 50% of the activating delayed-rectifier K+ current in isolated guinea pig ventricularmyocytes				J Med Chem 44: 3764-7 (2001) BindingDB Entry DOI: 10.7270/Q2G1604C
					More data for this Ligand-Target Pair
ATP synthase subunit beta,/delta,/epsilon,/gamma, mitochondrial (Bos taurus)	BDBM50404286 (CHEMBL7982) Show SMILES Cc1ccc(NC(=S)OC(Cn2ccnc2)c2ccc(Cl)cc2Cl)c(C)c1 Show InChI InChI=1S/C20H19Cl2N3OS/c1-13-3-6-18(14(2)9-13)24-20(27)26-19(11-25-8-7-23-12-25)16-5-4-15(21)10-17(16)22/h3-10,12,19H,11H2,1-2H3,(H,24,27)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibitory activity against bovine mitochondrial F1F0-ATP synthase				Bioorg Med Chem Lett 14: 1027-30 (2004) Article DOI: 10.1016/j.bmcl.2003.11.077 BindingDB Entry DOI: 10.7270/Q2VX0HQ9
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 1 (Cavia porcellus)	BDBM50106166 (CHEMBL122341 | N-(3,3-Dimethyl-butyl)-4-hexyloxy-b...) Show SMILES CCCCCCOc1ccc(cc1)C(=O)NCCC(C)(C)C Show InChI InChI=1S/C19H31NO2/c1-5-6-7-8-15-22-17-11-9-16(10-12-17)18(21)20-14-13-19(2,3)4/h9-12H,5-8,13-15H2,1-4H3,(H,20,21)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	250	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Molar concentration required to inhibit 50% of the activating delayed-rectifier K+ current in isolated guinea pig ventricularmyocytes				J Med Chem 44: 3764-7 (2001) BindingDB Entry DOI: 10.7270/Q2G1604C
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 1 (Cavia porcellus)	BDBM50106177 (CHEMBL431682 | N-(3,3-Dimethyl-butyl)-4-indol-1-yl...) Show SMILES CC(C)(C)CCNC(=O)c1ccc(cc1)-n1ccc2ccccc12 Show InChI InChI=1S/C21H24N2O/c1-21(2,3)13-14-22-20(24)17-8-10-18(11-9-17)23-15-12-16-6-4-5-7-19(16)23/h4-12,15H,13-14H2,1-3H3,(H,22,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Molar concentration required to inhibit 50% of the activating delayed-rectifier K+ current in isolated guinea pig ventricularmyocytes				J Med Chem 44: 3764-7 (2001) BindingDB Entry DOI: 10.7270/Q2G1604C
					More data for this Ligand-Target Pair
ATP synthase subunit beta,/delta,/epsilon,/gamma, mitochondrial (Bos taurus)	BDBM50404287 (CHEMBL8116) Show SMILES OC(C(Nc1ccc(Cl)cc1)=NC(Cn1ccnc1)c1ccc(Cl)cc1Cl)c1ccc(cc1)C#N |w:11.12| Show InChI InChI=1S/C26H20Cl3N5O/c27-19-5-8-21(9-6-19)32-26(25(35)18-3-1-17(14-30)2-4-18)33-24(15-34-12-11-31-16-34)22-10-7-20(28)13-23(22)29/h1-13,16,24-25,35H,15H2,(H,32,33)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	280	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibitory activity against bovine mitochondrial F1F0-ATP synthase				Bioorg Med Chem Lett 14: 1027-30 (2004) Article DOI: 10.1016/j.bmcl.2003.11.077 BindingDB Entry DOI: 10.7270/Q2VX0HQ9
					More data for this Ligand-Target Pair
Neprilysin (Homo sapiens (Human))	BDBM50287137 (2-{2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2-phe...) Show SMILES CCCCC(NC(=O)C(Cc1ccccc1)CP(O)(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(O)=O Show InChI InChI=1S/C32H39N2O7P/c1-2-3-19-28(31(36)37)33-30(35)27(20-24-13-7-4-8-14-24)23-42(39,40)29(21-25-15-9-5-10-16-25)34-32(38)41-22-26-17-11-6-12-18-26/h4-18,27-29H,2-3,19-23H2,1H3,(H,33,35)(H,34,38)(H,36,37)(H,39,40)/t27?,28?,29-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of neutral endopeptidase in human umbilical vein endothelial cells				Bioorg Med Chem Lett 6: 1323-1326 (1996) Article DOI: 10.1016/0960-894X(96)00227-2 BindingDB Entry DOI: 10.7270/Q2Q81DKV
					More data for this Ligand-Target Pair
Neprilysin (Homo sapiens (Human))	BDBM50287140 (2-{2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2-phe...) Show SMILES CC(NC(=O)C(Cc1ccccc1)CP(O)(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(O)=O Show InChI InChI=1S/C29H33N2O7P/c1-21(28(33)34)30-27(32)25(17-22-11-5-2-6-12-22)20-39(36,37)26(18-23-13-7-3-8-14-23)31-29(35)38-19-24-15-9-4-10-16-24/h2-16,21,25-26H,17-20H2,1H3,(H,30,32)(H,31,35)(H,33,34)(H,36,37)/t21?,25?,26-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of neutral endopeptidase in human umbilical vein endothelial cells				Bioorg Med Chem Lett 6: 1323-1326 (1996) Article DOI: 10.1016/0960-894X(96)00227-2 BindingDB Entry DOI: 10.7270/Q2Q81DKV
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 1 (Cavia porcellus)	BDBM50106184 (CHEMBL121751 | N-(3,3-Dimethyl-cyclopentyl)-4-hexy...) Show SMILES CCCCCCOc1ccc(cc1)C(=O)NC1CCC(C)(C)C1 Show InChI InChI=1S/C20H31NO2/c1-4-5-6-7-14-23-18-10-8-16(9-11-18)19(22)21-17-12-13-20(2,3)15-17/h8-11,17H,4-7,12-15H2,1-3H3,(H,21,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	360	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Molar concentration required to inhibit 50% of the activating delayed-rectifier K+ current in isolated guinea pig ventricularmyocytes				J Med Chem 44: 3764-7 (2001) BindingDB Entry DOI: 10.7270/Q2G1604C
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 1 (Cavia porcellus)	BDBM50106180 (CHEMBL124595 | N-(3,3-Dimethyl-cyclohexylmethyl)-4...) Show SMILES CCCCCCOc1ccc(cc1)C(=O)NCC1CCCC(C)(C)C1 Show InChI InChI=1S/C22H35NO2/c1-4-5-6-7-15-25-20-12-10-19(11-13-20)21(24)23-17-18-9-8-14-22(2,3)16-18/h10-13,18H,4-9,14-17H2,1-3H3,(H,23,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	370	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Molar concentration required to inhibit 50% of the activating delayed-rectifier K+ current in isolated guinea pig ventricularmyocytes				J Med Chem 44: 3764-7 (2001) BindingDB Entry DOI: 10.7270/Q2G1604C
					More data for this Ligand-Target Pair
Endothelin-converting enzyme 1 (Homo sapiens (Human))	BDBM50287138 (2-[(2-{[hydroxy(4-phenyl-butyl)phosphoryl]amino}-3...) Show SMILES OC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NP(O)(=O)CCCCc1ccccc1 Show InChI InChI=1S/C30H34N3O5P/c34-29(32-28(30(35)36)20-24-21-31-26-17-8-7-16-25(24)26)27(19-23-14-5-2-6-15-23)33-39(37,38)18-10-9-13-22-11-3-1-4-12-22/h1-8,11-12,14-17,21,27-28,31H,9-10,13,18-20H2,(H,32,34)(H,35,36)(H2,33,37,38)/t27-,28-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of endothelin-converting enzyme in human umbilical vein endothelial cells				Bioorg Med Chem Lett 6: 1323-1326 (1996) Article DOI: 10.1016/0960-894X(96)00227-2 BindingDB Entry DOI: 10.7270/Q2Q81DKV
					More data for this Ligand-Target Pair
ATP synthase subunit beta,/delta,/epsilon,/gamma, mitochondrial (Bos taurus)	BDBM50404289 (CHEMBL8376) Show SMILES Clc1ccc(NC(=S)OC(Cn2ccnc2)c2ccc(Cl)cc2Cl)cc1 Show InChI InChI=1S/C18H14Cl3N3OS/c19-12-1-4-14(5-2-12)23-18(26)25-17(10-24-8-7-22-11-24)15-6-3-13(20)9-16(15)21/h1-9,11,17H,10H2,(H,23,26)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	430	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibitory activity against bovine mitochondrial F1F0 ATP hydrolase				Bioorg Med Chem Lett 14: 1027-30 (2004) Article DOI: 10.1016/j.bmcl.2003.11.077 BindingDB Entry DOI: 10.7270/Q2VX0HQ9
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 1 (Cavia porcellus)	BDBM50106181 (Biphenyl-4-carboxylic acid (3,3-dimethyl-butyl)-am...) Show SMILES CC(C)(C)CCNC(=O)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C19H23NO/c1-19(2,3)13-14-20-18(21)17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-12H,13-14H2,1-3H3,(H,20,21)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	540	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Molar concentration required to inhibit 50% of the activating delayed-rectifier K+ current in isolated guinea pig ventricularmyocytes				J Med Chem 44: 3764-7 (2001) BindingDB Entry DOI: 10.7270/Q2G1604C
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 1 (Cavia porcellus)	BDBM50106164 (CHEMBL123569 | Enantiomer-N-(2,2-Dimethyl-cyclopen...) Show SMILES Cc1noc(n1)-c1ccc(cc1)C(=O)NCC1CCCC1(C)C Show InChI InChI=1S/C18H23N3O2/c1-12-20-17(23-21-12)14-8-6-13(7-9-14)16(22)19-11-15-5-4-10-18(15,2)3/h6-9,15H,4-5,10-11H2,1-3H3,(H,19,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	580	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bindind affinity value obtained by measuring the displacement of radioligand [3H]-(-)-cytisine from a preparation of whole rat brain				J Med Chem 44: 3764-7 (2001) BindingDB Entry DOI: 10.7270/Q2G1604C
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 1 (Cavia porcellus)	BDBM50106164 (CHEMBL123569 | Enantiomer-N-(2,2-Dimethyl-cyclopen...) Show SMILES Cc1noc(n1)-c1ccc(cc1)C(=O)NCC1CCCC1(C)C Show InChI InChI=1S/C18H23N3O2/c1-12-20-17(23-21-12)14-8-6-13(7-9-14)16(22)19-11-15-5-4-10-18(15,2)3/h6-9,15H,4-5,10-11H2,1-3H3,(H,19,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	580	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Molar concentration required to inhibit 50% of the activating delayed-rectifier K+ current in isolated guinea pig ventricularmyocytes				J Med Chem 44: 3764-7 (2001) BindingDB Entry DOI: 10.7270/Q2G1604C
					More data for this Ligand-Target Pair
ATP synthase subunit beta,/delta,/epsilon,/gamma, mitochondrial (Bos taurus)	BDBM50404301 (CHEMBL7871) Show SMILES Clc1ccc(NC(NC(Cn2ccnc2)c2ccc(Cl)cc2Cl)=NC#N)c(Cl)c1 |w:23.25| Show InChI InChI=1S/C19H14Cl4N6/c20-12-1-3-14(15(22)7-12)18(9-29-6-5-25-11-29)28-19(26-10-24)27-17-4-2-13(21)8-16(17)23/h1-8,11,18H,9H2,(H2,26,27,28)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibitory activity against bovine mitochondrial F1F0-ATP synthase				Bioorg Med Chem Lett 14: 1027-30 (2004) Article DOI: 10.1016/j.bmcl.2003.11.077 BindingDB Entry DOI: 10.7270/Q2VX0HQ9
					More data for this Ligand-Target Pair
ATP synthase subunit beta,/delta,/epsilon,/gamma, mitochondrial (Bos taurus)	BDBM50404284 (CHEMBL8064) Show SMILES Cc1ccc(NC(=S)OC(Cn2ccnc2)c2ccc(Cl)cc2Cl)cc1 Show InChI InChI=1S/C19H17Cl2N3OS/c1-13-2-5-15(6-3-13)23-19(26)25-18(11-24-9-8-22-12-24)16-7-4-14(20)10-17(16)21/h2-10,12,18H,11H2,1H3,(H,23,26)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	660	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibitory activity against bovine mitochondrial F1F0 ATP hydrolase				Bioorg Med Chem Lett 14: 1027-30 (2004) Article DOI: 10.1016/j.bmcl.2003.11.077 BindingDB Entry DOI: 10.7270/Q2VX0HQ9
					More data for this Ligand-Target Pair
ATP synthase subunit beta,/delta,/epsilon,/gamma, mitochondrial (Bos taurus)	BDBM50404285 (CHEMBL8025) Show SMILES FC(F)(F)c1ccc(c(c1)C(Cn1ccnc1)NC(Nc1ccc(Cl)cc1Cl)=NC#N)C(F)(F)F |w:28.31| Show InChI InChI=1S/C21H14Cl2F6N6/c22-13-2-4-17(16(23)8-13)33-19(32-10-30)34-18(9-35-6-5-31-11-35)14-7-12(20(24,25)26)1-3-15(14)21(27,28)29/h1-8,11,18H,9H2,(H2,32,33,34)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	710	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibitory activity against bovine mitochondrial F1F0 ATP hydrolase				Bioorg Med Chem Lett 14: 1027-30 (2004) Article DOI: 10.1016/j.bmcl.2003.11.077 BindingDB Entry DOI: 10.7270/Q2VX0HQ9
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 1 (Cavia porcellus)	BDBM50106175 (CHEMBL121750 | Enantiomer-N-(2,2-Dimethyl-cyclopen...) Show SMILES CCCCCCOc1ccc(cc1)C(=O)NCC1CCCC1(C)C Show InChI InChI=1S/C21H33NO2/c1-4-5-6-7-15-24-19-12-10-17(11-13-19)20(23)22-16-18-9-8-14-21(18,2)3/h10-13,18H,4-9,14-16H2,1-3H3,(H,22,23)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	710	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Molar concentration required to inhibit 50% of the activating delayed-rectifier K+ current in isolated guinea pig ventricularmyocytes				J Med Chem 44: 3764-7 (2001) BindingDB Entry DOI: 10.7270/Q2G1604C
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 1 (Cavia porcellus)	BDBM50106175 (CHEMBL121750 | Enantiomer-N-(2,2-Dimethyl-cyclopen...) Show SMILES CCCCCCOc1ccc(cc1)C(=O)NCC1CCCC1(C)C Show InChI InChI=1S/C21H33NO2/c1-4-5-6-7-15-24-19-12-10-17(11-13-19)20(23)22-16-18-9-8-14-21(18,2)3/h10-13,18H,4-9,14-16H2,1-3H3,(H,22,23)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	710	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Bindind affinity value obtained by measuring the displacement of radioligand [3H]-(-)-cytisine from whole rat brain Nicotinic acetylcholine receptor				J Med Chem 44: 3764-7 (2001) BindingDB Entry DOI: 10.7270/Q2G1604C
					More data for this Ligand-Target Pair
Neprilysin (Homo sapiens (Human))	BDBM50287136 (2-{(R)-2-Benzyl-3-[(1-benzyloxycarbonylamino-2-phe...) Show SMILES NC(=N)NCCCC(NC(=O)C(Cc1ccccc1)CP(O)(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(O)=O Show InChI InChI=1S/C32H40N5O7P/c33-31(34)35-18-10-17-27(30(39)40)36-29(38)26(19-23-11-4-1-5-12-23)22-45(42,43)28(20-24-13-6-2-7-14-24)37-32(41)44-21-25-15-8-3-9-16-25/h1-9,11-16,26-28H,10,17-22H2,(H,36,38)(H,37,41)(H,39,40)(H,42,43)(H4,33,34,35)/t26?,27?,28-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of neutral endopeptidase in human umbilical vein endothelial cells				Bioorg Med Chem Lett 6: 1323-1326 (1996) Article DOI: 10.1016/0960-894X(96)00227-2 BindingDB Entry DOI: 10.7270/Q2Q81DKV
					More data for this Ligand-Target Pair
Neprilysin (Homo sapiens (Human))	BDBM50287134 (2-{2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2-phe...) Show SMILES OC(=O)C(Cc1ccccc1)NC(=O)C(Cc1ccccc1)CP(O)(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 Show InChI InChI=1S/C35H37N2O7P/c38-33(36-31(34(39)40)22-27-15-7-2-8-16-27)30(21-26-13-5-1-6-14-26)25-45(42,43)32(23-28-17-9-3-10-18-28)37-35(41)44-24-29-19-11-4-12-20-29/h1-20,30-32H,21-25H2,(H,36,38)(H,37,41)(H,39,40)(H,42,43)/t30?,31?,32-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of neutral endopeptidase in human umbilical vein endothelial cells				Bioorg Med Chem Lett 6: 1323-1326 (1996) Article DOI: 10.1016/0960-894X(96)00227-2 BindingDB Entry DOI: 10.7270/Q2Q81DKV
					More data for this Ligand-Target Pair
Neprilysin (Homo sapiens (Human))	BDBM50287129 (2-{2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2-phe...) Show SMILES OC(=O)CC(NC(=O)C(Cc1ccccc1)CP(O)(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(O)=O Show InChI InChI=1S/C30H33N2O9P/c33-27(34)18-25(29(36)37)31-28(35)24(16-21-10-4-1-5-11-21)20-42(39,40)26(17-22-12-6-2-7-13-22)32-30(38)41-19-23-14-8-3-9-15-23/h1-15,24-26H,16-20H2,(H,31,35)(H,32,38)(H,33,34)(H,36,37)(H,39,40)/t24?,25?,26-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of neutral endopeptidase in human umbilical vein endothelial cells				Bioorg Med Chem Lett 6: 1323-1326 (1996) Article DOI: 10.1016/0960-894X(96)00227-2 BindingDB Entry DOI: 10.7270/Q2Q81DKV
					More data for this Ligand-Target Pair
Endothelin-converting enzyme 1 (Homo sapiens (Human))	BDBM50251742 ((3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydro...) Show SMILES CC(C)C[C@H](NP(O)(=O)O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |r| Show InChI InChI=1S/C23H34N3O10P/c1-11(2)8-16(26-37(33,34)36-23-20(29)19(28)18(27)12(3)35-23)21(30)25-17(22(31)32)9-13-10-24-15-7-5-4-6-14(13)15/h4-7,10-12,16-20,23-24,27-29H,8-9H2,1-3H3,(H,25,30)(H,31,32)(H2,26,33,34)/t12-,16-,17-,18-,19+,20+,23-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article	n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of endothelin-converting enzyme in human umbilical vein endothelial cells				Bioorg Med Chem Lett 6: 1323-1326 (1996) Article DOI: 10.1016/0960-894X(96)00227-2 BindingDB Entry DOI: 10.7270/Q2Q81DKV
					More data for this Ligand-Target Pair				3D Structure (crystal)
Neprilysin (Homo sapiens (Human))	BDBM50287147 (CHEMBL282158 | {2-Benzyl-3-[((R)-1-benzyloxycarbon...) Show SMILES OC(=O)CNC(=O)C(Cc1ccccc1)CP(O)(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 Show InChI InChI=1S/C28H31N2O7P/c31-26(32)18-29-27(33)24(16-21-10-4-1-5-11-21)20-38(35,36)25(17-22-12-6-2-7-13-22)30-28(34)37-19-23-14-8-3-9-15-23/h1-15,24-25H,16-20H2,(H,29,33)(H,30,34)(H,31,32)(H,35,36)/t24?,25-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of neutral endopeptidase in human umbilical vein endothelial cells				Bioorg Med Chem Lett 6: 1323-1326 (1996) Article DOI: 10.1016/0960-894X(96)00227-2 BindingDB Entry DOI: 10.7270/Q2Q81DKV
					More data for this Ligand-Target Pair
Endothelin-converting enzyme 1 (Homo sapiens (Human))	BDBM50287130 (2-{2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2-phe...) Show SMILES OC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(Cc1ccccc1)CP(O)(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 Show InChI InChI=1S/C37H38N3O7P/c41-35(39-33(36(42)43)22-29-23-38-32-19-11-10-18-31(29)32)30(20-26-12-4-1-5-13-26)25-48(45,46)34(21-27-14-6-2-7-15-27)40-37(44)47-24-28-16-8-3-9-17-28/h1-19,23,30,33-34,38H,20-22,24-25H2,(H,39,41)(H,40,44)(H,42,43)(H,45,46)/t30?,33?,34-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of endothelin-converting enzyme in human umbilical vein endothelial cells				Bioorg Med Chem Lett 6: 1323-1326 (1996) Article DOI: 10.1016/0960-894X(96)00227-2 BindingDB Entry DOI: 10.7270/Q2Q81DKV
					More data for this Ligand-Target Pair
Endothelin-converting enzyme 1 (Homo sapiens (Human))	BDBM50287130 (2-{2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2-phe...) Show SMILES OC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(Cc1ccccc1)CP(O)(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 Show InChI InChI=1S/C37H38N3O7P/c41-35(39-33(36(42)43)22-29-23-38-32-19-11-10-18-31(29)32)30(20-26-12-4-1-5-13-26)25-48(45,46)34(21-27-14-6-2-7-15-27)40-37(44)47-24-28-16-8-3-9-17-28/h1-19,23,30,33-34,38H,20-22,24-25H2,(H,39,41)(H,40,44)(H,42,43)(H,45,46)/t30?,33?,34-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of neutral endopeptidase in human umbilical vein endothelial cells				Bioorg Med Chem Lett 6: 1323-1326 (1996) Article DOI: 10.1016/0960-894X(96)00227-2 BindingDB Entry DOI: 10.7270/Q2Q81DKV
					More data for this Ligand-Target Pair
Neprilysin (Homo sapiens (Human))	BDBM50287150 (2-{2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2-phe...) Show SMILES CCC(C)C(NC(=O)C(Cc1ccccc1)CP(O)(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(O)=O Show InChI InChI=1S/C32H39N2O7P/c1-3-23(2)29(31(36)37)34-30(35)27(19-24-13-7-4-8-14-24)22-42(39,40)28(20-25-15-9-5-10-16-25)33-32(38)41-21-26-17-11-6-12-18-26/h4-18,23,27-29H,3,19-22H2,1-2H3,(H,33,38)(H,34,35)(H,36,37)(H,39,40)/t23?,27?,28-,29?/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of neutral endopeptidase in human umbilical vein endothelial cells				Bioorg Med Chem Lett 6: 1323-1326 (1996) Article DOI: 10.1016/0960-894X(96)00227-2 BindingDB Entry DOI: 10.7270/Q2Q81DKV
					More data for this Ligand-Target Pair
Neprilysin (Homo sapiens (Human))	BDBM50287130 (2-{2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2-phe...) Show SMILES OC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(Cc1ccccc1)CP(O)(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 Show InChI InChI=1S/C37H38N3O7P/c41-35(39-33(36(42)43)22-29-23-38-32-19-11-10-18-31(29)32)30(20-26-12-4-1-5-13-26)25-48(45,46)34(21-27-14-6-2-7-15-27)40-37(44)47-24-28-16-8-3-9-17-28/h1-19,23,30,33-34,38H,20-22,24-25H2,(H,39,41)(H,40,44)(H,42,43)(H,45,46)/t30?,33?,34-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of neutral endopeptidase in human umbilical vein endothelial cells				Bioorg Med Chem Lett 6: 1323-1326 (1996) Article DOI: 10.1016/0960-894X(96)00227-2 BindingDB Entry DOI: 10.7270/Q2Q81DKV
					More data for this Ligand-Target Pair
Neprilysin (Homo sapiens (Human))	BDBM50287130 (2-{2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2-phe...) Show SMILES OC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(Cc1ccccc1)CP(O)(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 Show InChI InChI=1S/C37H38N3O7P/c41-35(39-33(36(42)43)22-29-23-38-32-19-11-10-18-31(29)32)30(20-26-12-4-1-5-13-26)25-48(45,46)34(21-27-14-6-2-7-15-27)40-37(44)47-24-28-16-8-3-9-17-28/h1-19,23,30,33-34,38H,20-22,24-25H2,(H,39,41)(H,40,44)(H,42,43)(H,45,46)/t30?,33?,34-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of neutral endopeptidase in human umbilical vein endothelial cells				Bioorg Med Chem Lett 6: 1323-1326 (1996) Article DOI: 10.1016/0960-894X(96)00227-2 BindingDB Entry DOI: 10.7270/Q2Q81DKV
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 1 (Cavia porcellus)	BDBM50106174 (CHEMBL332297 | N-(2,2-Dimethyl-cyclohexylmethyl)-4...) Show SMILES CCCCCCOc1ccc(cc1)C(=O)NCC1CCCCC1(C)C Show InChI InChI=1S/C22H35NO2/c1-4-5-6-9-16-25-20-13-11-18(12-14-20)21(24)23-17-19-10-7-8-15-22(19,2)3/h11-14,19H,4-10,15-17H2,1-3H3,(H,23,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Molar concentration required to inhibit 50% of the activating delayed-rectifier K+ current in isolated guinea pig ventricularmyocytes				J Med Chem 44: 3764-7 (2001) BindingDB Entry DOI: 10.7270/Q2G1604C
					More data for this Ligand-Target Pair
ATP synthase subunit beta,/delta,/epsilon,/gamma, mitochondrial (Bos taurus)	BDBM50404290 (CHEMBL8473) Show SMILES Clc1ccc(C(Cn2ccnc2)NC(Nc2ccccc2Cl)=NC#N)c(Cl)c1 |w:22.24| Show InChI InChI=1S/C19H15Cl3N6/c20-13-5-6-14(16(22)9-13)18(10-28-8-7-24-12-28)27-19(25-11-23)26-17-4-2-1-3-15(17)21/h1-9,12,18H,10H2,(H2,25,26,27)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.23E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibitory activity against bovine mitochondrial F1F0 ATP hydrolase				Bioorg Med Chem Lett 14: 1027-30 (2004) Article DOI: 10.1016/j.bmcl.2003.11.077 BindingDB Entry DOI: 10.7270/Q2VX0HQ9
					More data for this Ligand-Target Pair
ATP synthase subunit beta,/delta,/epsilon,/gamma, mitochondrial (Bos taurus)	BDBM50404300 (CHEMBL7894) Show SMILES CCC(=O)C(NC(Cn1ccnc1)c1ccc(Cl)cc1Cl)Nc1ccc(Cl)cc1 Show InChI InChI=1S/C21H21Cl3N4O/c1-2-20(29)21(26-16-6-3-14(22)4-7-16)27-19(12-28-10-9-25-13-28)17-8-5-15(23)11-18(17)24/h3-11,13,19,21,26-27H,2,12H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.27E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibitory activity against bovine mitochondrial F1F0 ATP hydrolase				Bioorg Med Chem Lett 14: 1027-30 (2004) Article DOI: 10.1016/j.bmcl.2003.11.077 BindingDB Entry DOI: 10.7270/Q2VX0HQ9
					More data for this Ligand-Target Pair
Neprilysin (Homo sapiens (Human))	BDBM50287139 (2-{2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2-phe...) Show SMILES OC(=O)C(Cc1ccc(O)cc1)NC(=O)C(Cc1ccccc1)CP(O)(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 Show InChI InChI=1S/C35H37N2O8P/c38-30-18-16-27(17-19-30)21-31(34(40)41)36-33(39)29(20-25-10-4-1-5-11-25)24-46(43,44)32(22-26-12-6-2-7-13-26)37-35(42)45-23-28-14-8-3-9-15-28/h1-19,29,31-32,38H,20-24H2,(H,36,39)(H,37,42)(H,40,41)(H,43,44)/t29?,31?,32-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of neutral endopeptidase in human umbilical vein endothelial cells				Bioorg Med Chem Lett 6: 1323-1326 (1996) Article DOI: 10.1016/0960-894X(96)00227-2 BindingDB Entry DOI: 10.7270/Q2Q81DKV
					More data for this Ligand-Target Pair
Neprilysin (Homo sapiens (Human))	BDBM50287139 (2-{2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2-phe...) Show SMILES OC(=O)C(Cc1ccc(O)cc1)NC(=O)C(Cc1ccccc1)CP(O)(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 Show InChI InChI=1S/C35H37N2O8P/c38-30-18-16-27(17-19-30)21-31(34(40)41)36-33(39)29(20-25-10-4-1-5-11-25)24-46(43,44)32(22-26-12-6-2-7-13-26)37-35(42)45-23-28-14-8-3-9-15-28/h1-19,29,31-32,38H,20-24H2,(H,36,39)(H,37,42)(H,40,41)(H,43,44)/t29?,31?,32-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of neutral endopeptidase in human umbilical vein endothelial cells				Bioorg Med Chem Lett 6: 1323-1326 (1996) Article DOI: 10.1016/0960-894X(96)00227-2 BindingDB Entry DOI: 10.7270/Q2Q81DKV
					More data for this Ligand-Target Pair
Neprilysin (Homo sapiens (Human))	BDBM50287141 (3-{2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2-phe...) Show SMILES OC(=O)CCNC(=O)C(Cc1ccccc1)CP(O)(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 Show InChI InChI=1S/C29H33N2O7P/c32-27(33)16-17-30-28(34)25(18-22-10-4-1-5-11-22)21-39(36,37)26(19-23-12-6-2-7-13-23)31-29(35)38-20-24-14-8-3-9-15-24/h1-15,25-26H,16-21H2,(H,30,34)(H,31,35)(H,32,33)(H,36,37)/t25?,26-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of neutral endopeptidase in human umbilical vein endothelial cells				Bioorg Med Chem Lett 6: 1323-1326 (1996) Article DOI: 10.1016/0960-894X(96)00227-2 BindingDB Entry DOI: 10.7270/Q2Q81DKV
					More data for this Ligand-Target Pair
ATP synthase subunit beta,/delta,/epsilon,/gamma, mitochondrial (Bos taurus)	BDBM50404299 (CHEMBL8199) Show SMILES Clc1ccc(NC(=S)NC(Cn2ccnc2)c2ccc(Cl)cc2Cl)c(Cl)c1 Show InChI InChI=1S/C18H14Cl4N4S/c19-11-1-3-13(14(21)7-11)17(9-26-6-5-23-10-26)25-18(27)24-16-4-2-12(20)8-15(16)22/h1-8,10,17H,9H2,(H2,24,25,27)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.41E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibitory activity against bovine mitochondrial F1F0-ATP synthase				Bioorg Med Chem Lett 14: 1027-30 (2004) Article DOI: 10.1016/j.bmcl.2003.11.077 BindingDB Entry DOI: 10.7270/Q2VX0HQ9
					More data for this Ligand-Target Pair

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