Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Endothelin-1 receptor' and Ligand = 'BDBM50288277'   

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))	BDBM50288277 (3-(4-Propyl-phenyl)-thiophene-2-sulfonic acid (4-b...) Show SMILES CCCc1ccc(cc1)-c1ccsc1S(=O)(=O)Nc1onc(C)c1Br Show InChI InChI=1S/C17H17BrN2O3S2/c1-3-4-12-5-7-13(8-6-12)14-9-10-24-17(14)25(21,22)20-16-15(18)11(2)19-23-16/h5-10,20H,3-4H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	87	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for binding affinity against Endothelin A receptor				Bioorg Med Chem Lett 6: 2651-2656 (1996) Article DOI: 10.1016/S0960-894X(96)00496-9 BindingDB Entry DOI: 10.7270/Q24M94HV
					More data for this Ligand-Target Pair