Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Estrogen receptor' and Ligand = 'BDBM50173663'   

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
Estrogen receptor (Homo sapiens (Human))	BDBM50173663 (4-[5-Hydroxy-2-(4-hydroxy-phenyl)-3H-inden-1-yl]-b...) Show SMILES NC(=O)c1ccc(cc1)C1=C(Cc2cc(O)ccc12)c1ccc(O)cc1 |t:10| Show InChI InChI=1S/C22H17NO3/c23-22(26)15-3-1-14(2-4-15)21-19-10-9-18(25)11-16(19)12-20(21)13-5-7-17(24)8-6-13/h1-11,24-25H,12H2,(H2,23,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Antagonistic activity against estrogen receptor alpha in presence of 0.1 nM estradiol				J Med Chem 48: 5989-6003 (2005) Article DOI: 10.1021/jm050226i BindingDB Entry DOI: 10.7270/Q2B857P7
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