BDBM50190035 (4R,5R)-5-((S)-(5-(4-fluorophenyl)thiophen-2-yl)(hydroxy)methyl)-4-(2-methoxyphenyl)-1-methylpyrrolidin-2-one::CHEMBL215923

SMILES: COc1ccccc1[C@H]1CC(=O)N(C)[C@H]1[C@H](O)c1ccc(s1)-c1ccc(F)cc1

InChI Key: InChIKey=LXPNGLWIJUJZMM-NLSFWIRASA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50190035   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Estradiol 17-beta-dehydrogenase 2 (Homo sapiens (Human))	BDBM50190035 ((4R,5R)-5-((S)-(5-(4-fluorophenyl)thiophen-2-yl)(h...) Show SMILES COc1ccccc1[C@H]1CC(=O)N(C)[C@H]1[C@H](O)c1ccc(s1)-c1ccc(F)cc1 Show InChI InChI=1S/C23H22FNO3S/c1-25-21(26)13-17(16-5-3-4-6-18(16)28-2)22(25)23(27)20-12-11-19(29-20)14-7-9-15(24)10-8-14/h3-12,17,22-23,27H,13H2,1-2H3/t17-,22-,23-/m1/s1	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
Bayer Research Center Curated by ChEMBL					Assay Description Inhibition of human recombinant 17beta-HSD2				Bioorg Med Chem Lett 16: 4965-8 (2006) Article DOI: 10.1016/j.bmcl.2006.06.041 BindingDB Entry DOI: 10.7270/Q2GB24V1
					More data for this Ligand-Target Pair