Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Estrogen receptor beta' and Ligand = 'BDBM312140'   

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 beta (Homo sapiens (Human))	BDBM312140 (6,8-dihydroxy-2-(4-hydroxyphenyl)-4-(4-methoxyphen...) Show SMILES COc1ccc(cc1)-c1cn(-c2ccc(O)cc2)c(=O)c2c(O)cc(O)cc12 Show InChI InChI=1S/C22H17NO5/c1-28-17-8-2-13(3-9-17)19-12-23(14-4-6-15(24)7-5-14)22(27)21-18(19)10-16(25)11-20(21)26/h2-12,24-26H,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.480	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GTX, Inc. US Patent					Assay Description Recombinant ER-α or ER-β ligand binding domain (LBD) was combined with [3H]E2 (PerkinElmer, Waltham, Mass.) in buffer A (10 mM Tris, pH 7.4...				US Patent US9623021 (2017) BindingDB Entry DOI: 10.7270/Q20C4XV9
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