Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Estrogen receptor' and Ligand = 'BDBM50294175'   

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))	BDBM50294175 (CHEMBL4167567) Show SMILES Brc1ccc2[nH]c(nc2c1)-c1cc2ccccc2[nH]1 Show InChI InChI=1S/C15H10BrN3/c16-10-5-6-12-13(8-10)19-15(18-12)14-7-9-3-1-2-4-11(9)17-14/h1-8,17H,(H,18,19)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
Central University of Punjab Curated by ChEMBL					Assay Description Displacement of fluoromone TM from recombinant human ERalpha after 2 hrs by fluorescence polarization analysis				Eur J Med Chem 146: 206-219 (2018) Article DOI: 10.1016/j.ejmech.2018.01.051 BindingDB Entry DOI: 10.7270/Q20C4Z9J
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