Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Estrogen receptor' and Ligand = 'BDBM50186729'   

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))	BDBM50186729 (CHEMBL3823192) Show SMILES COc1ccc(\C=C(\C(=O)N(C)CCCCCCCCCCCCn2c(c(C)c3cc(O)ccc23)-c2ccc(O)cc2)c2cc(OC)c(OC)c(OC)c2)cc1O Show InChI InChI=1S/C47H58N2O8/c1-32-38-31-37(51)22-23-40(38)49(45(32)34-18-20-36(50)21-19-34)26-16-14-12-10-8-7-9-11-13-15-25-48(2)47(53)39(27-33-17-24-42(54-3)41(52)28-33)35-29-43(55-4)46(57-6)44(30-35)56-5/h17-24,27-31,50-52H,7-16,25-26H2,1-6H3/b39-27+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	574	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Inhibition of ER-alpha (unknown origin) by Lanthascreen-FRET assay				Bioorg Med Chem 24: 4075-4099 (2016) Article DOI: 10.1016/j.bmc.2016.06.050 BindingDB Entry DOI: 10.7270/Q2T43W1S
					More data for this Ligand-Target Pair