Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Endothelin receptor type B' and Ligand = 'BDBM50289937'   

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))	BDBM50289937 (3-(4-Chloro-3-methyl-isoxazol-5-ylsulfamoyl)-thiop...) Show SMILES Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2ccccc2)c1Cl Show InChI InChI=1S/C15H12ClN3O4S2/c1-9-12(16)15(23-18-9)19-25(21,22)11-7-8-24-13(11)14(20)17-10-5-3-2-4-6-10/h2-8,19H,1H3,(H,17,20)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	>1.00E+5	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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