Compile Data Set for Download or QSAR

Found 50 hits with Last Name = 'facchini' and Initial = 'v'   

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 (RAT)	BDBM50065516 ((R)-4-[2-Cyano-5-(pyridin-3-ylmethoxy)-phenoxy]-4-...) Show SMILES Cc1ccccc1[C@@H](CCC(O)=O)Oc1cc(OCc2cccnc2)ccc1C#N Show InChI InChI=1S/C24H22N2O4/c1-17-5-2-3-7-21(17)22(10-11-24(27)28)30-23-13-20(9-8-19(23)14-25)29-16-18-6-4-12-26-15-18/h2-9,12-13,15,22H,10-11,16H2,1H3,(H,27,28)/t22-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat A10 cell Endothelin A receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin-1 receptor (RAT)	BDBM50065508 ((R)-4-[2-Cyano-5-(thiophen-3-ylmethoxy)-phenoxy]-4...) Show SMILES Cc1ccccc1[C@@H](CCC(O)=O)Oc1cc(OCc2ccsc2)ccc1C#N Show InChI InChI=1S/C23H21NO4S/c1-16-4-2-3-5-20(16)21(8-9-23(25)26)28-22-12-19(7-6-18(22)13-24)27-14-17-10-11-29-15-17/h2-7,10-12,15,21H,8-9,14H2,1H3,(H,25,26)/t21-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat A10 cell Endothelin A receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin-1 receptor (RAT)	BDBM50065518 (4-[2-Cyano-5-(thiophen-3-ylmethoxy)-phenoxy]-4-o-t...) Show SMILES Cc1ccccc1C(CCC(O)=O)Oc1cc(OCc2ccsc2)ccc1C#N Show InChI InChI=1S/C23H21NO4S/c1-16-4-2-3-5-20(16)21(8-9-23(25)26)28-22-12-19(7-6-18(22)13-24)27-14-17-10-11-29-15-17/h2-7,10-12,15,21H,8-9,14H2,1H3,(H,25,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat A10 cell Endothelin A receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin-1 receptor (RAT)	BDBM50065523 ((R)-4-[2-Cyano-5-(isothiazol-4-ylmethoxy)-phenoxy]...) Show SMILES Cc1ccccc1[C@@H](CCC(O)=O)Oc1cc(OCc2cnsc2)ccc1C#N Show InChI InChI=1S/C22H20N2O4S/c1-15-4-2-3-5-19(15)20(8-9-22(25)26)28-21-10-18(7-6-17(21)11-23)27-13-16-12-24-29-14-16/h2-7,10,12,14,20H,8-9,13H2,1H3,(H,25,26)/t20-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat A10 cell Endothelin A receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin-1 receptor (RAT)	BDBM50065524 (5-[2-(3-Carboxy-1-o-tolyl-propoxy)-4-(thiophen-3-y...) Show SMILES Cc1ccccc1C(CCC(O)=O)Oc1cc(OCc2ccsc2)ccc1-c1cc([nH]n1)C(O)=O Show InChI InChI=1S/C26H24N2O6S/c1-16-4-2-3-5-19(16)23(8-9-25(29)30)34-24-12-18(33-14-17-10-11-35-15-17)6-7-20(24)21-13-22(26(31)32)28-27-21/h2-7,10-13,15,23H,8-9,14H2,1H3,(H,27,28)(H,29,30)(H,31,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat A10 cell Endothelin A receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin-1 receptor (RAT)	BDBM50329850 ((R)-3-Amino-4-[(S)-2-((R)-1-{(S)-1-[(R)-1-(1H-indo...) 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 |r| 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+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat A10 cell Endothelin A receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin-1 receptor (RAT)	BDBM50065525 (4-[2-(1H-Pyrazol-3-yl)-5-(thiophen-3-ylmethoxy)-ph...) Show SMILES Cc1ccccc1C(CCC(O)=O)Oc1cc(OCc2ccsc2)ccc1-c1cc[nH]n1 Show InChI InChI=1S/C25H24N2O4S/c1-17-4-2-3-5-20(17)23(8-9-25(28)29)31-24-14-19(30-15-18-11-13-32-16-18)6-7-21(24)22-10-12-26-27-22/h2-7,10-14,16,23H,8-9,15H2,1H3,(H,26,27)(H,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat A10 cell Endothelin A receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin-1 receptor (RAT)	BDBM50065515 ((R)-4-[2-Cyano-5-(pyridin-4-ylmethoxy)-phenoxy]-4-...) Show SMILES Cc1ccccc1[C@@H](CCC(O)=O)Oc1cc(OCc2ccncc2)ccc1C#N Show InChI InChI=1S/C24H22N2O4/c1-17-4-2-3-5-21(17)22(8-9-24(27)28)30-23-14-20(7-6-19(23)15-25)29-16-18-10-12-26-13-11-18/h2-7,10-14,22H,8-9,16H2,1H3,(H,27,28)/t22-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat A10 cell Endothelin A receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin-1 receptor (RAT)	BDBM50065513 (4-[2-Oxazol-2-yl-5-(thiophen-3-ylmethoxy)-phenoxy]...) Show SMILES Cc1ccccc1C(CCC(O)=O)Oc1cc(OCc2ccsc2)ccc1-c1ncco1 Show InChI InChI=1S/C25H23NO5S/c1-17-4-2-3-5-20(17)22(8-9-24(27)28)31-23-14-19(30-15-18-10-13-32-16-18)6-7-21(23)25-26-11-12-29-25/h2-7,10-14,16,22H,8-9,15H2,1H3,(H,27,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat A10 cell Endothelin A receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Sterol O-acyltransferase 1 (Rattus norvegicus)	BDBM50051901 (1-[5-(4,5-Diphenyl-1H-imidazol-2-ylsulfanyl)-penty...) Show SMILES Cc1cc(C)n(CCCCCSc2nc(c([nH]2)-c2ccccc2)-c2ccccc2)n1 Show InChI InChI=1S/C25H28N4S/c1-19-18-20(2)29(28-19)16-10-5-11-17-30-25-26-23(21-12-6-3-7-13-21)24(27-25)22-14-8-4-9-15-22/h3-4,6-9,12-15,18H,5,10-11,16-17H2,1-2H3,(H,26,27)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase in microsomes from rat liver				Bioorg Med Chem Lett 6: 47-50 (1996) Article DOI: 10.1016/0960-894X(95)00555-8 BindingDB Entry DOI: 10.7270/Q2N29WXG
					More data for this Ligand-Target Pair
Endothelin-1 receptor (RAT)	BDBM50065521 (4-[2-Acetyl-5-(thiophen-3-ylmethoxy)-phenoxy]-4-o-...) Show SMILES CC(=O)c1ccc(OCc2ccsc2)cc1OC(CCC(O)=O)c1ccccc1C Show InChI InChI=1S/C24H24O5S/c1-16-5-3-4-6-20(16)22(9-10-24(26)27)29-23-13-19(7-8-21(23)17(2)25)28-14-18-11-12-30-15-18/h3-8,11-13,15,22H,9-10,14H2,1-2H3,(H,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	26	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat A10 cell Endothelin A receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin-1 receptor (RAT)	BDBM50065512 (4-[2-Carbamoyl-5-(thiophen-3-ylmethoxy)-phenoxy]-4...) Show SMILES Cc1ccccc1C(CCC(O)=O)Oc1cc(OCc2ccsc2)ccc1C(N)=O Show InChI InChI=1S/C23H23NO5S/c1-15-4-2-3-5-18(15)20(8-9-22(25)26)29-21-12-17(6-7-19(21)23(24)27)28-13-16-10-11-30-14-16/h2-7,10-12,14,20H,8-9,13H2,1H3,(H2,24,27)(H,25,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat A10 cell Endothelin A receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase (Oryctolagus cuniculus)	BDBM50051901 (1-[5-(4,5-Diphenyl-1H-imidazol-2-ylsulfanyl)-penty...) Show SMILES Cc1cc(C)n(CCCCCSc2nc(c([nH]2)-c2ccccc2)-c2ccccc2)n1 Show InChI InChI=1S/C25H28N4S/c1-19-18-20(2)29(28-19)16-10-5-11-17-30-25-26-23(21-12-6-3-7-13-21)24(27-25)22-14-8-4-9-15-22/h3-4,6-9,12-15,18H,5,10-11,16-17H2,1-2H3,(H,26,27)	PDB Reactome pathway KEGG UniProtKB/TrEMBL DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase in microsomes from rabbit artery.				Bioorg Med Chem Lett 6: 47-50 (1996) Article DOI: 10.1016/0960-894X(95)00555-8 BindingDB Entry DOI: 10.7270/Q2N29WXG
					More data for this Ligand-Target Pair
Endothelin-1 receptor (RAT)	BDBM50065520 (4-[2-Pyridin-2-yl-5-(thiophen-3-ylmethoxy)-phenoxy...) Show SMILES Cc1ccccc1C(CCC(O)=O)Oc1cc(OCc2ccsc2)ccc1-c1ccccn1 Show InChI InChI=1S/C27H25NO4S/c1-19-6-2-3-7-22(19)25(11-12-27(29)30)32-26-16-21(31-17-20-13-15-33-18-20)9-10-23(26)24-8-4-5-14-28-24/h2-10,13-16,18,25H,11-12,17H2,1H3,(H,29,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat A10 cell Endothelin A receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase (Oryctolagus cuniculus)	BDBM50051901 (1-[5-(4,5-Diphenyl-1H-imidazol-2-ylsulfanyl)-penty...) Show SMILES Cc1cc(C)n(CCCCCSc2nc(c([nH]2)-c2ccccc2)-c2ccccc2)n1 Show InChI InChI=1S/C25H28N4S/c1-19-18-20(2)29(28-19)16-10-5-11-17-30-25-26-23(21-12-6-3-7-13-21)24(27-25)22-14-8-4-9-15-22/h3-4,6-9,12-15,18H,5,10-11,16-17H2,1-2H3,(H,26,27)	PDB Reactome pathway KEGG UniProtKB/TrEMBL DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	44	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase in microsomes from rabbit liver.				Bioorg Med Chem Lett 6: 47-50 (1996) Article DOI: 10.1016/0960-894X(95)00555-8 BindingDB Entry DOI: 10.7270/Q2N29WXG
					More data for this Ligand-Target Pair
Endothelin-1 receptor (RAT)	BDBM50065522 ((R)-4-[5-(Benzo[1,3]dioxol-5-ylmethoxy)-2-cyano-ph...) Show SMILES Cc1ccccc1[C@@H](CCC(O)=O)Oc1cc(OCc2ccc3OCOc3c2)ccc1C#N Show InChI InChI=1S/C26H23NO6/c1-17-4-2-3-5-21(17)22(10-11-26(28)29)33-24-13-20(8-7-19(24)14-27)30-15-18-6-9-23-25(12-18)32-16-31-23/h2-9,12-13,22H,10-11,15-16H2,1H3,(H,28,29)/t22-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	69	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat A10 cell Endothelin A receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase (Oryctolagus cuniculus)	BDBM50051901 (1-[5-(4,5-Diphenyl-1H-imidazol-2-ylsulfanyl)-penty...) Show SMILES Cc1cc(C)n(CCCCCSc2nc(c([nH]2)-c2ccccc2)-c2ccccc2)n1 Show InChI InChI=1S/C25H28N4S/c1-19-18-20(2)29(28-19)16-10-5-11-17-30-25-26-23(21-12-6-3-7-13-21)24(27-25)22-14-8-4-9-15-22/h3-4,6-9,12-15,18H,5,10-11,16-17H2,1-2H3,(H,26,27)	PDB Reactome pathway KEGG UniProtKB/TrEMBL DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase in microsomes from rabbit adrenal.				Bioorg Med Chem Lett 6: 47-50 (1996) Article DOI: 10.1016/0960-894X(95)00555-8 BindingDB Entry DOI: 10.7270/Q2N29WXG
					More data for this Ligand-Target Pair
Sterol O-acyltransferase 1 (Rattus norvegicus)	BDBM50051884 (1-[5-(4,5-Diphenyl-1H-imidazole-2-sulfinyl)-pentyl...) Show SMILES Cc1cc(C)n(CCCCCS(=O)c2nc(c([nH]2)-c2ccccc2)-c2ccccc2)n1 Show InChI InChI=1S/C25H28N4OS/c1-19-18-20(2)29(28-19)16-10-5-11-17-31(30)25-26-23(21-12-6-3-7-13-21)24(27-25)22-14-8-4-9-15-22/h3-4,6-9,12-15,18H,5,10-11,16-17H2,1-2H3,(H,26,27)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	86	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase in microsomes from rat liver				Bioorg Med Chem Lett 6: 47-50 (1996) Article DOI: 10.1016/0960-894X(95)00555-8 BindingDB Entry DOI: 10.7270/Q2N29WXG
					More data for this Ligand-Target Pair
Sterol O-acyltransferase 1 (Homo sapiens (Human))	BDBM50051884 (1-[5-(4,5-Diphenyl-1H-imidazole-2-sulfinyl)-pentyl...) Show SMILES Cc1cc(C)n(CCCCCS(=O)c2nc(c([nH]2)-c2ccccc2)-c2ccccc2)n1 Show InChI InChI=1S/C25H28N4OS/c1-19-18-20(2)29(28-19)16-10-5-11-17-31(30)25-26-23(21-12-6-3-7-13-21)24(27-25)22-14-8-4-9-15-22/h3-4,6-9,12-15,18H,5,10-11,16-17H2,1-2H3,(H,26,27)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	108	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase in microsomes from HEP G2 cells.				Bioorg Med Chem Lett 6: 47-50 (1996) Article DOI: 10.1016/0960-894X(95)00555-8 BindingDB Entry DOI: 10.7270/Q2N29WXG
					More data for this Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase (Oryctolagus cuniculus)	BDBM50051901 (1-[5-(4,5-Diphenyl-1H-imidazol-2-ylsulfanyl)-penty...) Show SMILES Cc1cc(C)n(CCCCCSc2nc(c([nH]2)-c2ccccc2)-c2ccccc2)n1 Show InChI InChI=1S/C25H28N4S/c1-19-18-20(2)29(28-19)16-10-5-11-17-30-25-26-23(21-12-6-3-7-13-21)24(27-25)22-14-8-4-9-15-22/h3-4,6-9,12-15,18H,5,10-11,16-17H2,1-2H3,(H,26,27)	PDB Reactome pathway KEGG UniProtKB/TrEMBL DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	108	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase in microsomes from rabbit liver.				Bioorg Med Chem Lett 6: 47-50 (1996) Article DOI: 10.1016/0960-894X(95)00555-8 BindingDB Entry DOI: 10.7270/Q2N29WXG
					More data for this Ligand-Target Pair
Endothelin-1 receptor (RAT)	BDBM50065514 (5-Oxo-5-[3-(thiophen-3-ylmethoxy)-phenyl]-4-o-toly...) Show SMILES Cc1ccccc1C(CCC(O)=O)C(=O)c1cccc(OCc2ccsc2)c1 Show InChI InChI=1S/C23H22O4S/c1-16-5-2-3-8-20(16)21(9-10-22(24)25)23(26)18-6-4-7-19(13-18)27-14-17-11-12-28-15-17/h2-8,11-13,15,21H,9-10,14H2,1H3,(H,24,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat A10 cell Endothelin A receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin-1 receptor (RAT)	BDBM50065511 ((S)-4-[2-Cyano-5-(thiophen-3-ylmethoxy)-phenoxy]-4...) Show SMILES Cc1ccccc1[C@H](CCC(O)=O)Oc1cc(OCc2ccsc2)ccc1C#N Show InChI InChI=1S/C23H21NO4S/c1-16-4-2-3-5-20(16)21(8-9-23(25)26)28-22-12-19(7-6-18(22)13-24)27-14-17-10-11-29-15-17/h2-7,10-12,15,21H,8-9,14H2,1H3,(H,25,26)/t21-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	113	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat A10 cell Endothelin A receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase (Oryctolagus cuniculus)	BDBM50051884 (1-[5-(4,5-Diphenyl-1H-imidazole-2-sulfinyl)-pentyl...) Show SMILES Cc1cc(C)n(CCCCCS(=O)c2nc(c([nH]2)-c2ccccc2)-c2ccccc2)n1 Show InChI InChI=1S/C25H28N4OS/c1-19-18-20(2)29(28-19)16-10-5-11-17-31(30)25-26-23(21-12-6-3-7-13-21)24(27-25)22-14-8-4-9-15-22/h3-4,6-9,12-15,18H,5,10-11,16-17H2,1-2H3,(H,26,27)	PDB Reactome pathway KEGG UniProtKB/TrEMBL DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	122	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase in microsomes from rabbit intestine.				Bioorg Med Chem Lett 6: 47-50 (1996) Article DOI: 10.1016/0960-894X(95)00555-8 BindingDB Entry DOI: 10.7270/Q2N29WXG
					More data for this Ligand-Target Pair
Sterol O-acyltransferase 1 (Homo sapiens (Human))	BDBM50051884 (1-[5-(4,5-Diphenyl-1H-imidazole-2-sulfinyl)-pentyl...) Show SMILES Cc1cc(C)n(CCCCCS(=O)c2nc(c([nH]2)-c2ccccc2)-c2ccccc2)n1 Show InChI InChI=1S/C25H28N4OS/c1-19-18-20(2)29(28-19)16-10-5-11-17-31(30)25-26-23(21-12-6-3-7-13-21)24(27-25)22-14-8-4-9-15-22/h3-4,6-9,12-15,18H,5,10-11,16-17H2,1-2H3,(H,26,27)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	164	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase in microsomes from THP-1 cells.				Bioorg Med Chem Lett 6: 47-50 (1996) Article DOI: 10.1016/0960-894X(95)00555-8 BindingDB Entry DOI: 10.7270/Q2N29WXG
					More data for this Ligand-Target Pair
Endothelin-1 receptor (RAT)	BDBM50065510 (2-(3-Carboxy-1-o-tolyl-propoxy)-4-(thiophen-3-ylme...) Show SMILES Cc1ccccc1C(CCC(O)=O)Oc1cc(OCc2ccsc2)ccc1C(O)=O Show InChI InChI=1S/C23H22O6S/c1-15-4-2-3-5-18(15)20(8-9-22(24)25)29-21-12-17(6-7-19(21)23(26)27)28-13-16-10-11-30-14-16/h2-7,10-12,14,20H,8-9,13H2,1H3,(H,24,25)(H,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	207	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat A10 cell Endothelin A receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase (Oryctolagus cuniculus)	BDBM50051884 (1-[5-(4,5-Diphenyl-1H-imidazole-2-sulfinyl)-pentyl...) Show SMILES Cc1cc(C)n(CCCCCS(=O)c2nc(c([nH]2)-c2ccccc2)-c2ccccc2)n1 Show InChI InChI=1S/C25H28N4OS/c1-19-18-20(2)29(28-19)16-10-5-11-17-31(30)25-26-23(21-12-6-3-7-13-21)24(27-25)22-14-8-4-9-15-22/h3-4,6-9,12-15,18H,5,10-11,16-17H2,1-2H3,(H,26,27)	PDB Reactome pathway KEGG UniProtKB/TrEMBL DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	208	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase in microsomes from rabbit intestine.				Bioorg Med Chem Lett 6: 47-50 (1996) Article DOI: 10.1016/0960-894X(95)00555-8 BindingDB Entry DOI: 10.7270/Q2N29WXG
					More data for this Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase (Oryctolagus cuniculus)	BDBM50051884 (1-[5-(4,5-Diphenyl-1H-imidazole-2-sulfinyl)-pentyl...) Show SMILES Cc1cc(C)n(CCCCCS(=O)c2nc(c([nH]2)-c2ccccc2)-c2ccccc2)n1 Show InChI InChI=1S/C25H28N4OS/c1-19-18-20(2)29(28-19)16-10-5-11-17-31(30)25-26-23(21-12-6-3-7-13-21)24(27-25)22-14-8-4-9-15-22/h3-4,6-9,12-15,18H,5,10-11,16-17H2,1-2H3,(H,26,27)	PDB Reactome pathway KEGG UniProtKB/TrEMBL DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	245	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase in microsomes from rabbit artery.				Bioorg Med Chem Lett 6: 47-50 (1996) Article DOI: 10.1016/0960-894X(95)00555-8 BindingDB Entry DOI: 10.7270/Q2N29WXG
					More data for this Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase (Oryctolagus cuniculus)	BDBM50051884 (1-[5-(4,5-Diphenyl-1H-imidazole-2-sulfinyl)-pentyl...) Show SMILES Cc1cc(C)n(CCCCCS(=O)c2nc(c([nH]2)-c2ccccc2)-c2ccccc2)n1 Show InChI InChI=1S/C25H28N4OS/c1-19-18-20(2)29(28-19)16-10-5-11-17-31(30)25-26-23(21-12-6-3-7-13-21)24(27-25)22-14-8-4-9-15-22/h3-4,6-9,12-15,18H,5,10-11,16-17H2,1-2H3,(H,26,27)	PDB Reactome pathway KEGG UniProtKB/TrEMBL DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	370	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase in microsomes from rabbit adrenal.				Bioorg Med Chem Lett 6: 47-50 (1996) Article DOI: 10.1016/0960-894X(95)00555-8 BindingDB Entry DOI: 10.7270/Q2N29WXG
					More data for this Ligand-Target Pair
Endothelin-1 receptor (RAT)	BDBM50065507 (4-[3-(Thiophen-3-ylmethoxy)-phenoxy]-4-o-tolyl-but...) Show SMILES Cc1ccccc1C(CCC(O)=O)Oc1cccc(OCc2ccsc2)c1 Show InChI InChI=1S/C22H22O4S/c1-16-5-2-3-8-20(16)21(9-10-22(23)24)26-19-7-4-6-18(13-19)25-14-17-11-12-27-15-17/h2-8,11-13,15,21H,9-10,14H2,1H3,(H,23,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	871	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat A10 cell Endothelin A receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin-1 receptor (RAT)	BDBM50065517 (5-(2,4-Bis-benzyloxy-phenyl)-1H-pyrazole-3-carboxy...) Show SMILES OC(=O)c1cc(n[nH]1)-c1ccc(OCc2ccccc2)cc1OCc1ccccc1 Show InChI InChI=1S/C24H20N2O4/c27-24(28)22-14-21(25-26-22)20-12-11-19(29-15-17-7-3-1-4-8-17)13-23(20)30-16-18-9-5-2-6-10-18/h1-14H,15-16H2,(H,25,26)(H,27,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat A10 cell Endothelin A receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin receptor type B (RAT)	BDBM50065524 (5-[2-(3-Carboxy-1-o-tolyl-propoxy)-4-(thiophen-3-y...) Show SMILES Cc1ccccc1C(CCC(O)=O)Oc1cc(OCc2ccsc2)ccc1-c1cc([nH]n1)C(O)=O Show InChI InChI=1S/C26H24N2O6S/c1-16-4-2-3-5-19(16)23(8-9-25(29)30)34-24-12-18(33-14-17-10-11-35-15-17)6-7-20(24)21-13-22(26(31)32)28-27-21/h2-7,10-13,15,23H,8-9,14H2,1H3,(H,27,28)(H,29,30)(H,31,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat cerebellum Endothelin B receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin receptor type B (RAT)	BDBM50065518 (4-[2-Cyano-5-(thiophen-3-ylmethoxy)-phenoxy]-4-o-t...) Show SMILES Cc1ccccc1C(CCC(O)=O)Oc1cc(OCc2ccsc2)ccc1C#N Show InChI InChI=1S/C23H21NO4S/c1-16-4-2-3-5-20(16)21(8-9-23(25)26)28-22-12-19(7-6-18(22)13-24)27-14-17-10-11-29-15-17/h2-7,10-12,15,21H,8-9,14H2,1H3,(H,25,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat cerebellum Endothelin B receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin receptor type B (RAT)	BDBM50065509 (4-[2-(1H-Imidazol-2-yl)-5-(thiophen-3-ylmethoxy)-p...) Show SMILES Cc1ccccc1C(CCC(O)=O)Oc1cc(OCc2ccsc2)ccc1-c1ncc[nH]1 Show InChI InChI=1S/C25H24N2O4S/c1-17-4-2-3-5-20(17)22(8-9-24(28)29)31-23-14-19(30-15-18-10-13-32-16-18)6-7-21(23)25-26-11-12-27-25/h2-7,10-14,16,22H,8-9,15H2,1H3,(H,26,27)(H,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat cerebellum Endothelin B receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin receptor type B (RAT)	BDBM50065521 (4-[2-Acetyl-5-(thiophen-3-ylmethoxy)-phenoxy]-4-o-...) Show SMILES CC(=O)c1ccc(OCc2ccsc2)cc1OC(CCC(O)=O)c1ccccc1C Show InChI InChI=1S/C24H24O5S/c1-16-5-3-4-6-20(16)22(9-10-24(26)27)29-23-13-19(7-8-21(23)17(2)25)28-14-18-11-12-30-15-18/h3-8,11-13,15,22H,9-10,14H2,1-2H3,(H,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat cerebellum Endothelin B receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin receptor type B (RAT)	BDBM50065512 (4-[2-Carbamoyl-5-(thiophen-3-ylmethoxy)-phenoxy]-4...) Show SMILES Cc1ccccc1C(CCC(O)=O)Oc1cc(OCc2ccsc2)ccc1C(N)=O Show InChI InChI=1S/C23H23NO5S/c1-15-4-2-3-5-18(15)20(8-9-22(25)26)29-21-12-17(6-7-19(21)23(24)27)28-13-16-10-11-30-14-16/h2-7,10-12,14,20H,8-9,13H2,1H3,(H2,24,27)(H,25,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat cerebellum Endothelin B receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin receptor type B (RAT)	BDBM50065515 ((R)-4-[2-Cyano-5-(pyridin-4-ylmethoxy)-phenoxy]-4-...) Show SMILES Cc1ccccc1[C@@H](CCC(O)=O)Oc1cc(OCc2ccncc2)ccc1C#N Show InChI InChI=1S/C24H22N2O4/c1-17-4-2-3-5-21(17)22(8-9-24(27)28)30-23-14-20(7-6-19(23)15-25)29-16-18-10-12-26-13-11-18/h2-7,10-14,22H,8-9,16H2,1H3,(H,27,28)/t22-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat cerebellum Endothelin B receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin receptor type B (RAT)	BDBM50065508 ((R)-4-[2-Cyano-5-(thiophen-3-ylmethoxy)-phenoxy]-4...) Show SMILES Cc1ccccc1[C@@H](CCC(O)=O)Oc1cc(OCc2ccsc2)ccc1C#N Show InChI InChI=1S/C23H21NO4S/c1-16-4-2-3-5-20(16)21(8-9-23(25)26)28-22-12-19(7-6-18(22)13-24)27-14-17-10-11-29-15-17/h2-7,10-12,15,21H,8-9,14H2,1H3,(H,25,26)/t21-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat cerebellum Endothelin B receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin receptor type B (RAT)	BDBM50065510 (2-(3-Carboxy-1-o-tolyl-propoxy)-4-(thiophen-3-ylme...) Show SMILES Cc1ccccc1C(CCC(O)=O)Oc1cc(OCc2ccsc2)ccc1C(O)=O Show InChI InChI=1S/C23H22O6S/c1-15-4-2-3-5-18(15)20(8-9-22(24)25)29-21-12-17(6-7-19(21)23(26)27)28-13-16-10-11-30-14-16/h2-7,10-12,14,20H,8-9,13H2,1H3,(H,24,25)(H,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat cerebellum Endothelin B receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin receptor type B (RAT)	BDBM50065513 (4-[2-Oxazol-2-yl-5-(thiophen-3-ylmethoxy)-phenoxy]...) Show SMILES Cc1ccccc1C(CCC(O)=O)Oc1cc(OCc2ccsc2)ccc1-c1ncco1 Show InChI InChI=1S/C25H23NO5S/c1-17-4-2-3-5-20(17)22(8-9-24(27)28)31-23-14-19(30-15-18-10-13-32-16-18)6-7-21(23)25-26-11-12-29-25/h2-7,10-14,16,22H,8-9,15H2,1H3,(H,27,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat cerebellum Endothelin B receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin receptor type B (RAT)	BDBM50065516 ((R)-4-[2-Cyano-5-(pyridin-3-ylmethoxy)-phenoxy]-4-...) Show SMILES Cc1ccccc1[C@@H](CCC(O)=O)Oc1cc(OCc2cccnc2)ccc1C#N Show InChI InChI=1S/C24H22N2O4/c1-17-5-2-3-7-21(17)22(10-11-24(27)28)30-23-13-20(9-8-19(23)14-25)29-16-18-6-4-12-26-15-18/h2-9,12-13,15,22H,10-11,16H2,1H3,(H,27,28)/t22-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat cerebellum Endothelin B receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin receptor type B (RAT)	BDBM50065525 (4-[2-(1H-Pyrazol-3-yl)-5-(thiophen-3-ylmethoxy)-ph...) Show SMILES Cc1ccccc1C(CCC(O)=O)Oc1cc(OCc2ccsc2)ccc1-c1cc[nH]n1 Show InChI InChI=1S/C25H24N2O4S/c1-17-4-2-3-5-20(17)23(8-9-25(28)29)31-24-14-19(30-15-18-11-13-32-16-18)6-7-21(24)22-10-12-26-27-22/h2-7,10-14,16,23H,8-9,15H2,1H3,(H,26,27)(H,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat cerebellum Endothelin B receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin receptor type B (RAT)	BDBM50065520 (4-[2-Pyridin-2-yl-5-(thiophen-3-ylmethoxy)-phenoxy...) Show SMILES Cc1ccccc1C(CCC(O)=O)Oc1cc(OCc2ccsc2)ccc1-c1ccccn1 Show InChI InChI=1S/C27H25NO4S/c1-19-6-2-3-7-22(19)25(11-12-27(29)30)32-26-16-21(31-17-20-13-15-33-18-20)9-10-23(26)24-8-4-5-14-28-24/h2-10,13-16,18,25H,11-12,17H2,1H3,(H,29,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat cerebellum Endothelin B receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin receptor type B (RAT)	BDBM50065523 ((R)-4-[2-Cyano-5-(isothiazol-4-ylmethoxy)-phenoxy]...) Show SMILES Cc1ccccc1[C@@H](CCC(O)=O)Oc1cc(OCc2cnsc2)ccc1C#N Show InChI InChI=1S/C22H20N2O4S/c1-15-4-2-3-5-19(15)20(8-9-22(25)26)28-21-10-18(7-6-17(21)11-23)27-13-16-12-24-29-14-16/h2-7,10,12,14,20H,8-9,13H2,1H3,(H,25,26)/t20-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat cerebellum Endothelin B receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin receptor type B (RAT)	BDBM50065522 ((R)-4-[5-(Benzo[1,3]dioxol-5-ylmethoxy)-2-cyano-ph...) Show SMILES Cc1ccccc1[C@@H](CCC(O)=O)Oc1cc(OCc2ccc3OCOc3c2)ccc1C#N Show InChI InChI=1S/C26H23NO6/c1-17-4-2-3-5-21(17)22(10-11-26(28)29)33-24-13-20(8-7-19(24)14-27)30-15-18-6-9-23-25(12-18)32-16-31-23/h2-9,12-13,22H,10-11,15-16H2,1H3,(H,28,29)/t22-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat cerebellum Endothelin B receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin receptor type B (RAT)	BDBM50065511 ((S)-4-[2-Cyano-5-(thiophen-3-ylmethoxy)-phenoxy]-4...) Show SMILES Cc1ccccc1[C@H](CCC(O)=O)Oc1cc(OCc2ccsc2)ccc1C#N Show InChI InChI=1S/C23H21NO4S/c1-16-4-2-3-5-20(16)21(8-9-23(25)26)28-22-12-19(7-6-18(22)13-24)27-14-17-10-11-29-15-17/h2-7,10-12,15,21H,8-9,14H2,1H3,(H,25,26)/t21-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat cerebellum Endothelin B receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin receptor type B (RAT)	BDBM50065514 (5-Oxo-5-[3-(thiophen-3-ylmethoxy)-phenyl]-4-o-toly...) Show SMILES Cc1ccccc1C(CCC(O)=O)C(=O)c1cccc(OCc2ccsc2)c1 Show InChI InChI=1S/C23H22O4S/c1-16-5-2-3-8-20(16)21(9-10-22(24)25)23(26)18-6-4-7-19(13-18)27-14-17-11-12-28-15-17/h2-8,11-13,15,21H,9-10,14H2,1H3,(H,24,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat cerebellum Endothelin B receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin receptor type B (RAT)	BDBM50065507 (4-[3-(Thiophen-3-ylmethoxy)-phenoxy]-4-o-tolyl-but...) Show SMILES Cc1ccccc1C(CCC(O)=O)Oc1cccc(OCc2ccsc2)c1 Show InChI InChI=1S/C22H22O4S/c1-16-5-2-3-8-20(16)21(9-10-22(23)24)26-19-7-4-6-18(13-19)25-14-17-11-12-27-15-17/h2-8,11-13,15,21H,9-10,14H2,1H3,(H,23,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat cerebellum Endothelin B receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin receptor type B (RAT)	BDBM50065517 (5-(2,4-Bis-benzyloxy-phenyl)-1H-pyrazole-3-carboxy...) Show SMILES OC(=O)c1cc(n[nH]1)-c1ccc(OCc2ccccc2)cc1OCc1ccccc1 Show InChI InChI=1S/C24H20N2O4/c27-24(28)22-14-21(25-26-22)20-12-11-19(29-15-17-7-3-1-4-8-17)13-23(20)30-16-18-9-5-2-6-10-18/h1-14H,15-16H2,(H,25,26)(H,27,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat cerebellum Endothelin B receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin receptor type B (RAT)	BDBM50329850 ((R)-3-Amino-4-[(S)-2-((R)-1-{(S)-1-[(R)-1-(1H-indo...) 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 |r| 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+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat cerebellum Endothelin B receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair
Endothelin-1 receptor (RAT)	BDBM50065509 (4-[2-(1H-Imidazol-2-yl)-5-(thiophen-3-ylmethoxy)-p...) Show SMILES Cc1ccccc1C(CCC(O)=O)Oc1cc(OCc2ccsc2)ccc1-c1ncc[nH]1 Show InChI InChI=1S/C25H24N2O4S/c1-17-4-2-3-5-20(17)22(8-9-24(28)29)31-23-14-19(30-15-18-10-13-32-16-18)6-7-21(23)25-26-11-12-27-25/h2-7,10-14,16,22H,8-9,15H2,1H3,(H,26,27)(H,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.63E+5	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Curated by ChEMBL					Assay Description In vitro inhibition of [125I]ET1 binding to rat A10 cell Endothelin A receptor.				J Med Chem 41: 2732-44 (1998) Article DOI: 10.1021/jm9707131 BindingDB Entry DOI: 10.7270/Q2HM594W
					More data for this Ligand-Target Pair