Compile Data Set for Download or QSAR

Found 85 hits Enz. Inhib. hit(s) with all data for entry = 50004865   

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
Endothelin-1 receptor (Homo sapiens (Human))	BDBM50029353 (CHEMBL414165 | [(5S,8S,11R,14R,16aR)-8-(1H-Indol-3...) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)c1cccs1 Show InChI InChI=1S/C32H38N6O7S/c1-17(2)13-21-28(41)34-22(14-18-16-33-20-8-4-3-7-19(18)20)29(42)36-23(15-26(39)40)32(45)38-11-5-9-24(38)30(43)37-27(31(44)35-21)25-10-6-12-46-25/h3-4,6-8,10,12,16-17,21-24,27,33H,5,9,11,13-15H2,1-2H3,(H,34,41)(H,35,44)(H,36,42)(H,37,43)(H,39,40)/t21-,22+,23+,24-,27+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.20	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Inhibitory effect of the compound against Human ET-A receptor				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50029353 (CHEMBL414165 | [(5S,8S,11R,14R,16aR)-8-(1H-Indol-3...) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)c1cccs1 Show InChI InChI=1S/C32H38N6O7S/c1-17(2)13-21-28(41)34-22(14-18-16-33-20-8-4-3-7-19(18)20)29(42)36-23(15-26(39)40)32(45)38-11-5-9-24(38)30(43)37-27(31(44)35-21)25-10-6-12-46-25/h3-4,6-8,10,12,16-17,21-24,27,33H,5,9,11,13-15H2,1-2H3,(H,34,41)(H,35,44)(H,36,42)(H,37,43)(H,39,40)/t21-,22+,23+,24-,27+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Inhibitory effect of the compound against porcine ET-A receptor				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50029353 (CHEMBL414165 | [(5S,8S,11R,14R,16aR)-8-(1H-Indol-3...) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)c1cccs1 Show InChI InChI=1S/C32H38N6O7S/c1-17(2)13-21-28(41)34-22(14-18-16-33-20-8-4-3-7-19(18)20)29(42)36-23(15-26(39)40)32(45)38-11-5-9-24(38)30(43)37-27(31(44)35-21)25-10-6-12-46-25/h3-4,6-8,10,12,16-17,21-24,27,33H,5,9,11,13-15H2,1-2H3,(H,34,41)(H,35,44)(H,36,42)(H,37,43)(H,39,40)/t21-,22+,23+,24-,27+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Homo sapiens (Human))	BDBM50029354 (CHEMBL133257 | [(5S,8S,11R,14S,16aR)-14-Cyclopenty...) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C1CCCC1 Show InChI InChI=1S/C33H44N6O7/c1-18(2)14-23-29(42)35-24(15-20-17-34-22-11-6-5-10-21(20)22)30(43)37-25(16-27(40)41)33(46)39-13-7-12-26(39)31(44)38-28(32(45)36-23)19-8-3-4-9-19/h5-6,10-11,17-19,23-26,28,34H,3-4,7-9,12-16H2,1-2H3,(H,35,42)(H,36,45)(H,37,43)(H,38,44)(H,40,41)/t23-,24+,25+,26-,28+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.40	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Inhibitory effect of the compound against Human ET-A receptor				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50029354 (CHEMBL133257 | [(5S,8S,11R,14S,16aR)-14-Cyclopenty...) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C1CCCC1 Show InChI InChI=1S/C33H44N6O7/c1-18(2)14-23-29(42)35-24(15-20-17-34-22-11-6-5-10-21(20)22)30(43)37-25(16-27(40)41)33(46)39-13-7-12-26(39)31(44)38-28(32(45)36-23)19-8-3-4-9-19/h5-6,10-11,17-19,23-26,28,34H,3-4,7-9,12-16H2,1-2H3,(H,35,42)(H,36,45)(H,37,43)(H,38,44)(H,40,41)/t23-,24+,25+,26-,28+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Inhibitory effect of the compound against porcine ET-A receptor				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50029354 (CHEMBL133257 | [(5S,8S,11R,14S,16aR)-14-Cyclopenty...) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C1CCCC1 Show InChI InChI=1S/C33H44N6O7/c1-18(2)14-23-29(42)35-24(15-20-17-34-22-11-6-5-10-21(20)22)30(43)37-25(16-27(40)41)33(46)39-13-7-12-26(39)31(44)38-28(32(45)36-23)19-8-3-4-9-19/h5-6,10-11,17-19,23-26,28,34H,3-4,7-9,12-16H2,1-2H3,(H,35,42)(H,36,45)(H,37,43)(H,38,44)(H,40,41)/t23-,24+,25+,26-,28+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Homo sapiens (Human))	BDBM50029352 (CHEMBL336033 | [(5S,8S,11R,14S,16aR)-8-(1H-Indol-3...) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C31H42N6O7/c1-16(2)12-21-27(40)33-22(13-18-15-32-20-9-6-5-8-19(18)20)28(41)35-23(14-25(38)39)31(44)37-11-7-10-24(37)29(42)36-26(17(3)4)30(43)34-21/h5-6,8-9,15-17,21-24,26,32H,7,10-14H2,1-4H3,(H,33,40)(H,34,43)(H,35,41)(H,36,42)(H,38,39)/t21-,22+,23+,24-,26+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	8.30	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Inhibitory effect of the compound against Human Endothelin A receptor				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407614 (CHEMBL137659) Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CC(C)C)NC1=O Show InChI InChI=1S/C32H44N6O7/c1-5-18(4)27-31(44)35-22(13-17(2)3)28(41)34-23(14-19-16-33-21-10-7-6-9-20(19)21)29(42)36-24(15-26(39)40)32(45)38-12-8-11-25(38)30(43)37-27/h6-7,9-10,16-18,22-25,27,33H,5,8,11-15H2,1-4H3,(H,34,41)(H,35,44)(H,36,42)(H,37,43)(H,39,40)/t18-,22+,23-,24-,25+,27-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407622 (CHEMBL2370830) Show SMILES [H][C@@]12CCCCN1C(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc1c[nH]c3ccccc13)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](NC2=O)C(C)C Show InChI InChI=1S/C32H44N6O7/c1-17(2)13-22-28(41)34-23(14-19-16-33-21-10-6-5-9-20(19)21)29(42)36-24(15-26(39)40)32(45)38-12-8-7-11-25(38)30(43)37-27(18(3)4)31(44)35-22/h5-6,9-10,16-18,22-25,27,33H,7-8,11-15H2,1-4H3,(H,34,41)(H,35,44)(H,36,42)(H,37,43)(H,39,40)/t22-,23+,24+,25+,27+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407565 (CHEMBL336563) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)(C)C Show InChI InChI=1S/C32H44N6O7/c1-17(2)13-21-27(41)34-22(14-18-16-33-20-10-7-6-9-19(18)20)28(42)36-23(15-25(39)40)31(45)38-12-8-11-24(38)29(43)37-26(30(44)35-21)32(3,4)5/h6-7,9-10,16-17,21-24,26,33H,8,11-15H2,1-5H3,(H,34,41)(H,35,44)(H,36,42)(H,37,43)(H,39,40)/t21-,22+,23+,24-,26-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407615 (CHEMBL343516) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2cn(C=O)c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C32H42N6O8/c1-17(2)12-21-28(42)33-22(13-19-15-37(16-39)24-9-6-5-8-20(19)24)29(43)35-23(14-26(40)41)32(46)38-11-7-10-25(38)30(44)36-27(18(3)4)31(45)34-21/h5-6,8-9,15-18,21-23,25,27H,7,10-14H2,1-4H3,(H,33,42)(H,34,45)(H,35,43)(H,36,44)(H,40,41)/t21-,22+,23+,25-,27+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407570 (CHEMBL2370825) Show SMILES [H][C@]12C[C@@H](O)CN1C(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc1c[nH]c3ccccc13)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](NC2=O)C(C)C Show InChI InChI=1S/C31H42N6O8/c1-15(2)9-21-27(41)33-22(10-17-13-32-20-8-6-5-7-19(17)20)28(42)35-23(12-25(39)40)31(45)37-14-18(38)11-24(37)29(43)36-26(16(3)4)30(44)34-21/h5-8,13,15-16,18,21-24,26,32,38H,9-12,14H2,1-4H3,(H,33,41)(H,34,44)(H,35,42)(H,36,43)(H,39,40)/t18-,21-,22+,23+,24-,26+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407612 (CHEMBL341994) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C1=CCC=CC1 |c:48,t:45| Show InChI InChI=1S/C34H42N6O7/c1-19(2)15-24-30(43)36-25(16-21-18-35-23-12-7-6-11-22(21)23)31(44)38-26(17-28(41)42)34(47)40-14-8-13-27(40)32(45)39-29(33(46)37-24)20-9-4-3-5-10-20/h3-4,6-7,10-12,18-19,24-27,29,35H,5,8-9,13-17H2,1-2H3,(H,36,43)(H,37,46)(H,38,44)(H,39,45)(H,41,42)/t24-,25+,26+,27-,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407600 (CHEMBL343062) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@H]2CSCN2C(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C30H40N6O7S/c1-15(2)9-20-26(39)32-21(10-17-12-31-19-8-6-5-7-18(17)19)27(40)34-22(11-24(37)38)30(43)36-14-44-13-23(36)28(41)35-25(16(3)4)29(42)33-20/h5-8,12,15-16,20-23,25,31H,9-11,13-14H2,1-4H3,(H,32,39)(H,33,42)(H,34,40)(H,35,41)(H,37,38)/t20-,21+,22+,23-,25+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50029351 (CHEMBL342615 | [(5R,8S,11R,14S,16aR)-8-(1H-Indol-3...) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@H]2CCCN2C(=O)[C@H](CS(O)(=O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C30H42N6O8S/c1-16(2)12-21-26(37)32-22(13-18-14-31-20-9-6-5-8-19(18)20)27(38)34-23(15-45(42,43)44)30(41)36-11-7-10-24(36)28(39)35-25(17(3)4)29(40)33-21/h5-6,8-9,14,16-17,21-25,31H,7,10-13,15H2,1-4H3,(H,32,37)(H,33,40)(H,34,38)(H,35,39)(H,42,43,44)/t21-,22+,23+,24-,25+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Inhibitory effect of the compound against porcine Endothelin A receptor				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50029351 (CHEMBL342615 | [(5R,8S,11R,14S,16aR)-8-(1H-Indol-3...) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@H]2CCCN2C(=O)[C@H](CS(O)(=O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C30H42N6O8S/c1-16(2)12-21-26(37)32-22(13-18-14-31-20-9-6-5-8-19(18)20)27(38)34-23(15-45(42,43)44)30(41)36-11-7-10-24(36)28(39)35-25(17(3)4)29(40)33-21/h5-6,8-9,14,16-17,21-25,31H,7,10-13,15H2,1-4H3,(H,32,37)(H,33,40)(H,34,38)(H,35,39)(H,42,43,44)/t21-,22+,23+,24-,25+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50029352 (CHEMBL336033 | [(5S,8S,11R,14S,16aR)-8-(1H-Indol-3...) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C31H42N6O7/c1-16(2)12-21-27(40)33-22(13-18-15-32-20-9-6-5-8-19(18)20)28(41)35-23(14-25(38)39)31(44)37-11-7-10-24(37)29(42)36-26(17(3)4)30(43)34-21/h5-6,8-9,15-17,21-24,26,32H,7,10-14H2,1-4H3,(H,33,40)(H,34,43)(H,35,41)(H,36,42)(H,38,39)/t21-,22+,23+,24-,26+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50029352 (CHEMBL336033 | [(5S,8S,11R,14S,16aR)-8-(1H-Indol-3...) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C31H42N6O7/c1-16(2)12-21-27(40)33-22(13-18-15-32-20-9-6-5-8-19(18)20)28(41)35-23(14-25(38)39)31(44)37-11-7-10-24(37)29(42)36-26(17(3)4)30(43)34-21/h5-6,8-9,15-17,21-24,26,32H,7,10-14H2,1-4H3,(H,33,40)(H,34,43)(H,35,41)(H,36,42)(H,38,39)/t21-,22+,23+,24-,26+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Inhibitory effect of the compound against porcine Endothelin A receptor				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407611 (CHEMBL343582) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)c1ccccc1 Show InChI InChI=1S/C34H40N6O7/c1-19(2)15-24-30(43)36-25(16-21-18-35-23-12-7-6-11-22(21)23)31(44)38-26(17-28(41)42)34(47)40-14-8-13-27(40)32(45)39-29(33(46)37-24)20-9-4-3-5-10-20/h3-7,9-12,18-19,24-27,29,35H,8,13-17H2,1-2H3,(H,36,43)(H,37,46)(H,38,44)(H,39,45)(H,41,42)/t24-,25+,26+,27-,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	24	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407601 (CHEMBL137716) Show SMILES COC(=O)n1cc(C[C@@H]2NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H]3CCCN3C(=O)[C@H](CC(O)=O)NC2=O)C(C)C)c2ccccc12 Show InChI InChI=1S/C33H44N6O9/c1-17(2)13-21-28(42)34-22(14-19-16-39(33(47)48-5)24-10-7-6-9-20(19)24)29(43)36-23(15-26(40)41)32(46)38-12-8-11-25(38)30(44)37-27(18(3)4)31(45)35-21/h6-7,9-10,16-18,21-23,25,27H,8,11-15H2,1-5H3,(H,34,42)(H,35,45)(H,36,43)(H,37,44)(H,40,41)/t21-,22+,23+,25-,27+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Homo sapiens (Human))	BDBM50029351 (CHEMBL342615 | [(5R,8S,11R,14S,16aR)-8-(1H-Indol-3...) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@H]2CCCN2C(=O)[C@H](CS(O)(=O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C30H42N6O8S/c1-16(2)12-21-26(37)32-22(13-18-14-31-20-9-6-5-8-19(18)20)27(38)34-23(15-45(42,43)44)30(41)36-11-7-10-24(36)28(39)35-25(17(3)4)29(40)33-21/h5-6,8-9,14,16-17,21-25,31H,7,10-13,15H2,1-4H3,(H,32,37)(H,33,40)(H,34,38)(H,35,39)(H,42,43,44)/t21-,22+,23+,24-,25+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Inhibitory effect of the compound against Human Endothelin A receptor				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407598 (CHEMBL132542) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)CN(C)C(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C29H40N6O7/c1-15(2)10-20-26(39)31-21(11-17-13-30-19-9-7-6-8-18(17)19)27(40)33-22(12-24(37)38)29(42)35(5)14-23(36)34-25(16(3)4)28(41)32-20/h6-9,13,15-16,20-22,25,30H,10-12,14H2,1-5H3,(H,31,39)(H,32,41)(H,33,40)(H,34,36)(H,37,38)/t20-,21+,22+,25+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407596 (CHEMBL422285) Show SMILES CCC[C@H]1NC(=O)[C@@H](NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C30H40N6O7/c1-4-8-20-26(39)33-21(13-17-15-31-19-10-6-5-9-18(17)19)27(40)34-22(14-24(37)38)30(43)36-12-7-11-23(36)28(41)35-25(16(2)3)29(42)32-20/h5-6,9-10,15-16,20-23,25,31H,4,7-8,11-14H2,1-3H3,(H,32,42)(H,33,39)(H,34,40)(H,35,41)(H,37,38)/t20-,21+,22+,23-,25+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	33	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407580 (CHEMBL263537) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@@H](C)N(C)C(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C30H42N6O7/c1-15(2)11-21-27(40)32-22(12-18-14-31-20-10-8-7-9-19(18)20)28(41)34-23(13-24(37)38)30(43)36(6)17(5)26(39)35-25(16(3)4)29(42)33-21/h7-10,14-17,21-23,25,31H,11-13H2,1-6H3,(H,32,40)(H,33,42)(H,34,41)(H,35,39)(H,37,38)/t17-,21-,22+,23+,25+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	34	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407571 (CHEMBL138120) Show SMILES CC(C)C[C@H]1N(C)C(=O)[C@@H](NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C32H44N6O7/c1-17(2)13-25-30(43)34-22(14-19-16-33-21-10-7-6-9-20(19)21)28(41)35-23(15-26(39)40)31(44)38-12-8-11-24(38)29(42)36-27(18(3)4)32(45)37(25)5/h6-7,9-10,16-18,22-25,27,33H,8,11-15H2,1-5H3,(H,34,43)(H,35,41)(H,36,42)(H,39,40)/t22-,23-,24+,25+,27-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	35	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407616 (CHEMBL342440) Show SMILES CCC[C@@H]1NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CC(C)C)NC1=O Show InChI InChI=1S/C31H42N6O7/c1-4-8-21-27(40)34-22(13-17(2)3)28(41)35-23(14-18-16-32-20-10-6-5-9-19(18)20)29(42)36-24(15-26(38)39)31(44)37-12-7-11-25(37)30(43)33-21/h5-6,9-10,16-17,21-25,32H,4,7-8,11-15H2,1-3H3,(H,33,43)(H,34,40)(H,35,41)(H,36,42)(H,38,39)/t21-,22+,23-,24-,25+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	47	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407621 (CHEMBL433853) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)(C)S Show InChI InChI=1S/C31H42N6O7S/c1-16(2)12-20-26(40)33-21(13-17-15-32-19-9-6-5-8-18(17)19)27(41)35-22(14-24(38)39)30(44)37-11-7-10-23(37)28(42)36-25(29(43)34-20)31(3,4)45/h5-6,8-9,15-16,20-23,25,32,45H,7,10-14H2,1-4H3,(H,33,40)(H,34,43)(H,35,41)(H,36,42)(H,38,39)/t20-,21+,22+,23-,25-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	49	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407617 (CHEMBL407771) Show SMILES CCCC[C@H]1NC(=O)[C@@H](NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C31H42N6O7/c1-4-5-10-21-27(40)34-22(14-18-16-32-20-11-7-6-9-19(18)20)28(41)35-23(15-25(38)39)31(44)37-13-8-12-24(37)29(42)36-26(17(2)3)30(43)33-21/h6-7,9,11,16-17,21-24,26,32H,4-5,8,10,12-15H2,1-3H3,(H,33,43)(H,34,40)(H,35,41)(H,36,42)(H,38,39)/t21-,22+,23+,24-,26+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	62	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407582 (CHEMBL1791008) Show SMILES CC[C@@H](C)[C@@H]1NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CC(C)C)NC1=O Show InChI InChI=1S/C32H44N6O7/c1-5-18(4)27-31(44)35-22(13-17(2)3)28(41)34-23(14-19-16-33-21-10-7-6-9-20(19)21)29(42)36-24(15-26(39)40)32(45)38-12-8-11-25(38)30(43)37-27/h6-7,9-10,16-18,22-25,27,33H,5,8,11-15H2,1-4H3,(H,34,41)(H,35,44)(H,36,42)(H,37,43)(H,39,40)/t18-,22-,23+,24+,25-,27+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	64	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407594 (CHEMBL335143) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C29H40N6O7/c1-14(2)10-20-27(40)32-21(11-17-13-30-19-9-7-6-8-18(17)19)28(41)33-22(12-23(36)37)26(39)31-16(5)25(38)35-24(15(3)4)29(42)34-20/h6-9,13-16,20-22,24,30H,10-12H2,1-5H3,(H,31,39)(H,32,40)(H,33,41)(H,34,42)(H,35,38)(H,36,37)/t16-,20-,21+,22+,24+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407579 (CHEMBL335416) Show SMILES CCCC[C@@H]1NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CC(C)C)NC1=O Show InChI InChI=1S/C32H44N6O7/c1-4-5-10-22-28(41)35-23(14-18(2)3)29(42)36-24(15-19-17-33-21-11-7-6-9-20(19)21)30(43)37-25(16-27(39)40)32(45)38-13-8-12-26(38)31(44)34-22/h6-7,9,11,17-18,22-26,33H,4-5,8,10,12-16H2,1-3H3,(H,34,44)(H,35,41)(H,36,42)(H,37,43)(H,39,40)/t22-,23+,24-,25-,26+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407604 (CHEMBL337567) Show SMILES CSCC[C@H]1NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](NC1=O)C(C)C Show InChI InChI=1S/C31H44N6O7S/c1-16(2)12-22-28(41)34-23(13-18-15-32-20-9-7-6-8-19(18)20)29(42)35-24(14-25(38)39)30(43)33-21(10-11-45-5)27(40)37-26(17(3)4)31(44)36-22/h6-9,15-17,21-24,26,32H,10-14H2,1-5H3,(H,33,43)(H,34,41)(H,35,42)(H,36,44)(H,37,40)(H,38,39)/t21-,22-,23+,24+,26+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407576 (CHEMBL407639) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@@H](CS(O)(=O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C29H40N6O10S/c1-14(2)9-19-25(38)31-20(10-16-12-30-18-8-6-5-7-17(16)18)26(39)32-21(11-23(36)37)27(40)34-22(13-46(43,44)45)28(41)35-24(15(3)4)29(42)33-19/h5-8,12,14-15,19-22,24,30H,9-11,13H2,1-4H3,(H,31,38)(H,32,39)(H,33,42)(H,34,40)(H,35,41)(H,36,37)(H,43,44,45)/t19-,20+,21+,22-,24+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407595 (CHEMBL342617) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C31H42N6O9/c1-15(2)11-21-28(43)34-22(12-17-14-32-19-8-6-5-7-18(17)19)29(44)35-23(13-25(40)41)30(45)33-20(9-10-24(38)39)27(42)37-26(16(3)4)31(46)36-21/h5-8,14-16,20-23,26,32H,9-13H2,1-4H3,(H,33,45)(H,34,43)(H,35,44)(H,36,46)(H,37,42)(H,38,39)(H,40,41)/t20-,21-,22+,23+,26+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407586 (CHEMBL137671) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C32H47N9O7/c1-16(2)12-22-28(45)38-23(13-18-15-36-20-9-6-5-8-19(18)20)29(46)39-24(14-25(42)43)30(47)37-21(10-7-11-35-32(33)34)27(44)41-26(17(3)4)31(48)40-22/h5-6,8-9,15-17,21-24,26,36H,7,10-14H2,1-4H3,(H,37,47)(H,38,45)(H,39,46)(H,40,48)(H,41,44)(H,42,43)(H4,33,34,35)/t21-,22-,23+,24+,26+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407599 (CHEMBL335128) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C37H45N7O7/c1-19(2)13-27-33(47)40-28(14-21-17-38-25-11-7-5-9-23(21)25)34(48)42-30(16-31(45)46)35(49)41-29(36(50)44-32(20(3)4)37(51)43-27)15-22-18-39-26-12-8-6-10-24(22)26/h5-12,17-20,27-30,32,38-39H,13-16H2,1-4H3,(H,40,47)(H,41,49)(H,42,48)(H,43,51)(H,44,50)(H,45,46)/t27-,28+,29-,30+,32+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407577 (CHEMBL136634) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C32H46N6O7/c1-16(2)11-22-28(41)35-24(13-19-15-33-21-10-8-7-9-20(19)21)29(42)36-25(14-26(39)40)30(43)34-23(12-17(3)4)31(44)38-27(18(5)6)32(45)37-22/h7-10,15-18,22-25,27,33H,11-14H2,1-6H3,(H,34,43)(H,35,41)(H,36,42)(H,37,45)(H,38,44)(H,39,40)/t22-,23-,24+,25+,27+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407587 (CHEMBL342840) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C31H43N7O8/c1-15(2)11-21-28(43)35-22(12-17-14-33-19-8-6-5-7-18(17)19)29(44)36-23(13-25(40)41)30(45)34-20(9-10-24(32)39)27(42)38-26(16(3)4)31(46)37-21/h5-8,14-16,20-23,26,33H,9-13H2,1-4H3,(H2,32,39)(H,34,45)(H,35,43)(H,36,44)(H,37,46)(H,38,42)(H,40,41)/t20-,21-,22+,23+,26+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407593 (CHEMBL337031) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C28H38N6O7/c1-14(2)9-19-26(39)31-20(10-16-12-29-18-8-6-5-7-17(16)18)27(40)32-21(11-23(36)37)25(38)30-13-22(35)34-24(15(3)4)28(41)33-19/h5-8,12,14-15,19-21,24,29H,9-11,13H2,1-4H3,(H,30,38)(H,31,39)(H,32,40)(H,33,41)(H,34,35)(H,36,37)/t19-,20+,21+,24+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407592 (CHEMBL137361) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C30H40N6O9/c1-14(2)9-19-26(41)32-20(10-16-13-31-18-8-6-5-7-17(16)18)27(42)33-21(11-23(37)38)28(43)34-22(12-24(39)40)29(44)36-25(15(3)4)30(45)35-19/h5-8,13-15,19-22,25,31H,9-12H2,1-4H3,(H,32,41)(H,33,42)(H,34,43)(H,35,45)(H,36,44)(H,37,38)(H,39,40)/t19-,20+,21+,22-,25+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407602 (CHEMBL135906) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@@H](CO)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C29H40N6O8/c1-14(2)9-19-25(39)31-20(10-16-12-30-18-8-6-5-7-17(16)18)26(40)32-21(11-23(37)38)27(41)34-22(13-36)28(42)35-24(15(3)4)29(43)33-19/h5-8,12,14-15,19-22,24,30,36H,9-11,13H2,1-4H3,(H,31,39)(H,32,40)(H,33,43)(H,34,41)(H,35,42)(H,37,38)/t19-,20+,21+,22-,24+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407608 (CHEMBL134562) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@@H](CCCCN)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C32H47N7O7/c1-17(2)13-23-29(43)36-24(14-19-16-34-21-10-6-5-9-20(19)21)30(44)37-25(15-26(40)41)31(45)35-22(11-7-8-12-33)28(42)39-27(18(3)4)32(46)38-23/h5-6,9-10,16-18,22-25,27,34H,7-8,11-15,33H2,1-4H3,(H,35,45)(H,36,43)(H,37,44)(H,38,46)(H,39,42)(H,40,41)/t22-,23-,24+,25+,27+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407606 (CHEMBL136210) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C35H44N6O7/c1-19(2)14-25-31(44)38-27(16-22-18-36-24-13-9-8-12-23(22)24)32(45)39-28(17-29(42)43)33(46)37-26(15-21-10-6-5-7-11-21)34(47)41-30(20(3)4)35(48)40-25/h5-13,18-20,25-28,30,36H,14-17H2,1-4H3,(H,37,46)(H,38,44)(H,39,45)(H,40,48)(H,41,47)(H,42,43)/t25-,26-,27+,28+,30+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407585 (CHEMBL1791007) Show SMILES CC[C@@H](C)[C@H]1NC(=O)[C@@H](NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C31H42N6O7/c1-5-17(4)26-30(43)33-21(13-18-15-32-20-10-7-6-9-19(18)20)27(40)34-22(14-24(38)39)31(44)37-12-8-11-23(37)28(41)35-25(16(2)3)29(42)36-26/h6-7,9-10,15-17,21-23,25-26,32H,5,8,11-14H2,1-4H3,(H,33,43)(H,34,40)(H,35,41)(H,36,42)(H,38,39)/t17-,21+,22+,23-,25+,26-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407610 (CHEMBL335780) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C32H42N8O7/c1-16(2)9-22-28(43)36-23(10-18-13-34-21-8-6-5-7-20(18)21)29(44)38-25(12-26(41)42)30(45)37-24(11-19-14-33-15-35-19)31(46)40-27(17(3)4)32(47)39-22/h5-8,13-17,22-25,27,34H,9-12H2,1-4H3,(H,33,35)(H,36,43)(H,37,45)(H,38,44)(H,39,47)(H,40,46)(H,41,42)/t22-,23+,24-,25+,27+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	240	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407618 (CHEMBL343768) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@@H](CS)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C29H40N6O7S/c1-14(2)9-19-25(38)31-20(10-16-12-30-18-8-6-5-7-17(16)18)26(39)32-21(11-23(36)37)27(40)34-22(13-43)28(41)35-24(15(3)4)29(42)33-19/h5-8,12,14-15,19-22,24,30,43H,9-11,13H2,1-4H3,(H,31,38)(H,32,39)(H,33,42)(H,34,40)(H,35,41)(H,36,37)/t19-,20+,21+,22-,24+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	240	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407567 (CHEMBL341443) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@@H](CCCN)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C31H45N7O7/c1-16(2)12-22-28(42)35-23(13-18-15-33-20-9-6-5-8-19(18)20)29(43)36-24(14-25(39)40)30(44)34-21(10-7-11-32)27(41)38-26(17(3)4)31(45)37-22/h5-6,8-9,15-17,21-24,26,33H,7,10-14,32H2,1-4H3,(H,34,44)(H,35,42)(H,36,43)(H,37,45)(H,38,41)(H,39,40)/t21-,22-,23+,24+,26+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	250	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407566 (CHEMBL137754) Show SMILES CC(C)C[C@H]1NC(=O)[C@H](C)NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O Show InChI InChI=1S/C29H38N6O7/c1-15(2)11-20-26(39)33-21(12-17-14-30-19-8-5-4-7-18(17)19)27(40)34-22(13-24(36)37)29(42)35-10-6-9-23(35)28(41)31-16(3)25(38)32-20/h4-5,7-8,14-16,20-23,30H,6,9-13H2,1-3H3,(H,31,41)(H,32,38)(H,33,39)(H,34,40)(H,36,37)/t16-,20+,21-,22-,23+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407569 (CHEMBL1791006) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)[C@H](C)O)C(C)C Show InChI InChI=1S/C30H42N6O8/c1-14(2)10-20-26(40)32-21(11-17-13-31-19-9-7-6-8-18(17)19)27(41)33-22(12-23(38)39)28(42)36-25(16(5)37)30(44)35-24(15(3)4)29(43)34-20/h6-9,13-16,20-22,24-25,31,37H,10-12H2,1-5H3,(H,32,40)(H,33,41)(H,34,43)(H,35,44)(H,36,42)(H,38,39)/t16-,20+,21-,22-,24-,25+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Sus scrofa)	BDBM50407575 (CHEMBL404763) Show SMILES CC(C)C[C@H]1NC(=O)[C@@H](NC(=O)C(C)(C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(C)C Show InChI InChI=1S/C30H42N6O7/c1-15(2)11-20-25(39)32-21(12-17-14-31-19-10-8-7-9-18(17)19)26(40)33-22(13-23(37)38)27(41)36-30(5,6)29(43)35-24(16(3)4)28(42)34-20/h7-10,14-16,20-22,24,31H,11-13H2,1-6H3,(H,32,39)(H,33,40)(H,34,42)(H,35,43)(H,36,41)(H,37,38)/t20-,21+,22+,24+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	330	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description The compound was tested for binding inhibitory activity against Endothelin A receptor from porcine aortic smooth muscle membranes.				J Med Chem 38: 4309-24 (1995) BindingDB Entry DOI: 10.7270/Q2D50M0H
					More data for this Ligand-Target Pair

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