Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Endothelin-1 receptor' and Ligand = 'BDBM50291481'   

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))	BDBM50291481 (2-(2,4,6-Trimethyl-phenoxymethyl)-thiophene-3-sulf...) Show SMILES Cc1noc(NS(=O)(=O)c2ccsc2COc2c(C)cc(C)cc2C)c1Br Show InChI InChI=1S/C18H19BrN2O4S2/c1-10-7-11(2)17(12(3)8-10)24-9-14-15(5-6-26-14)27(22,23)21-18-16(19)13(4)20-25-18/h5-8,21H,9H2,1-4H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	62	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of I-ET-1 binding to human Endothelin A receptor				Bioorg Med Chem Lett 7: 933-938 (1997) Article DOI: 10.1016/S0960-894X(97)00132-7 BindingDB Entry DOI: 10.7270/Q2DV1JWM
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Homo sapiens (Human))	BDBM50291481 (2-(2,4,6-Trimethyl-phenoxymethyl)-thiophene-3-sulf...) Show SMILES Cc1noc(NS(=O)(=O)c2ccsc2COc2c(C)cc(C)cc2C)c1Br Show InChI InChI=1S/C18H19BrN2O4S2/c1-10-7-11(2)17(12(3)8-10)24-9-14-15(5-6-26-14)27(22,23)21-18-16(19)13(4)20-25-18/h5-8,21H,9H2,1-4H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	6.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory of human Endothelin A receptor by using I-ET-1 as radioligand in a competitive radioligand assay				Bioorg Med Chem Lett 7: 939-944 (1997) Article DOI: 10.1016/S0960-894X(97)00133-9 BindingDB Entry DOI: 10.7270/Q2959HKC
					More data for this Ligand-Target Pair