BDBM50020639 7-Acetyl-4a,7-dimethyl-4b,5,6,7,8,8a,9,10-octahydro-4aH-phenanthren-2-one::CHEMBL158326

SMILES: CC(=O)C1(C)CCC2C(CCC3=CC(=O)C=CC23C)C1

InChI Key: InChIKey=PSVGTAYPKIYITQ-UHFFFAOYSA-N

Data: 1 KI

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 = 50020639   

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))	BDBM50020639 (7-Acetyl-4a,7-dimethyl-4b,5,6,7,8,8a,9,10-octahydr...) Show SMILES CC(=O)C1(C)CCC2C(CCC3=CC(=O)C=CC23C)C1 |c:15,t:11| Show InChI InChI=1S/C18H24O2/c1-12(19)17(2)8-7-16-13(11-17)4-5-14-10-15(20)6-9-18(14,16)3/h6,9-10,13,16H,4-5,7-8,11H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4.50E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Competitive inhibition of binding to human placental aromatase Cytochrome P450 19A1				J Med Chem 32: 651-8 (1989) BindingDB Entry DOI: 10.7270/Q29024CR
					More data for this Ligand-Target Pair