Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Endothelin receptor type B' and Ligand = 'BDBM50289943'   

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 receptor type B (Homo sapiens (Human))	BDBM50289943 (3-(4-Bromo-3-methyl-isoxazol-5-ylsulfamoyl)-thioph...) Show SMILES Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Oc2ccc(C)cc2)c1Br Show InChI InChI=1S/C16H13BrN2O5S2/c1-9-3-5-11(6-4-9)23-16(20)14-12(7-8-25-14)26(21,22)19-15-13(17)10(2)18-24-15/h3-8,19H,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	9.21E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro binding affinity in a radioligand binding experiment by competition with [125I]-labeled endothelin-1 for ETB receptor				Bioorg Med Chem Lett 7: 2093-2098 (1997) Article DOI: 10.1016/S0960-894X(97)00367-3 BindingDB Entry DOI: 10.7270/Q2WH2PZF
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