Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Estrogen receptor' and Ligand = 'BDBM50294180'   

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))	BDBM50294180 (CHEMBL4164944) Show SMILES Brc1cnc2[nH]c(nc2c1)-c1cc2ccccc2n1Cc1ccccc1 Show InChI InChI=1S/C21H15BrN4/c22-16-11-17-20(23-12-16)25-21(24-17)19-10-15-8-4-5-9-18(15)26(19)13-14-6-2-1-3-7-14/h1-12H,13H2,(H,23,24,25)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	300	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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