BDBM50332825 (4S,8R,9S,10S,13S,14S)-10-(hydroxymethyl)-4-methoxy-13-methyl-3,4,7,8,9,10,11,12,13,14,15,16-dodecahydro-1H-cyclopenta[alpha]phenanthren-17(2H)-one::CHEMBL1630275

SMILES: CO[C@H]1CCC[C@]2(CO)[C@H]3CC[C@@]4(C)[C@@H](CCC4=O)[C@@H]3CC=C12

InChI Key: InChIKey=XYTIMWXLVRWAHO-FHSQRROHSA-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 = 50332825   

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
Cytochrome P450 19A1 (Homo sapiens (Human))	BDBM50332825 ((4S,8R,9S,10S,13S,14S)-10-(hydroxymethyl)-4-methox...) Show SMILES CO[C@H]1CCC[C@]2(CO)[C@H]3CC[C@@]4(C)[C@@H](CCC4=O)[C@@H]3CC=C12 |r,t:23| Show InChI InChI=1S/C20H30O3/c1-19-11-9-15-13(14(19)7-8-18(19)22)5-6-16-17(23-2)4-3-10-20(15,16)12-21/h6,13-15,17,21H,3-5,7-12H2,1-2H3/t13-,14-,15-,17-,19-,20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
Tianjin University of Science and Technology Curated by ChEMBL					Assay Description Inhibition of human placental aromatase				Eur J Med Chem 45: 5612-20 (2010) Checked by Author Article DOI: 10.1016/j.ejmech.2010.09.011 BindingDB Entry DOI: 10.7270/Q2G44QH8
					More data for this Ligand-Target Pair