Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Estrogen receptor beta' and Ligand = 'BDBM50190350'   

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))	BDBM50190350 ((1S,12R,14R)-5-hydroxy-10-methyl-14-propyltetracyc...) Show SMILES CCC[C@@H]1C[C@@H]2C[C@]11Cc3cc(O)ccc3C1=C(C)C2=O |t:19| Show InChI InChI=1S/C19H22O2/c1-3-4-14-7-13-10-19(14)9-12-8-15(20)5-6-16(12)17(19)11(2)18(13)21/h5-6,8,13-14,20H,3-4,7,9-10H2,1-2H3/t13-,14-,19-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human recombinant ERbeta by scintillation proximity assay				Bioorg Med Chem Lett 16: 4462-6 (2006) Article DOI: 10.1016/j.bmcl.2006.06.043 BindingDB Entry DOI: 10.7270/Q2V124DH
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