BindingDB logo
myBDB logout

BDBM50014564 10,13-Dimethyl-7-phenyl-1,8,9,10,11,12,13,14,15,16-decahydro-2H-cyclopenta[a]phenanthrene-3,17-dione::CHEMBL266788

SMILES: CC12CCC3C(C1CCC2=O)C(=CC1=CC(=O)CCC31C)c1ccccc1

InChI Key: InChIKey=OPLIQEAVVVBVAF-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 = 50014564   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Cytochrome P450 19A1


(Homo sapiens (Human))
BDBM50014564
PNG
(10,13-Dimethyl-7-phenyl-1,8,9,10,11,12,13,14,15,16...)
Show SMILES CC12CCC3C(C1CCC2=O)C(=CC1=CC(=O)CCC31C)c1ccccc1 |c:13,t:15|
Show InChI InChI=1S/C25H28O2/c1-24-12-10-18(26)14-17(24)15-19(16-6-4-3-5-7-16)23-20-8-9-22(27)25(20,2)13-11-21(23)24/h3-7,14-15,20-21,23H,8-13H2,1-2H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
1.42E+3n/an/an/an/an/an/an/an/a



Ohio State University

Curated by ChEMBL


Assay Description
In vitro inhibition of human placental cytochrome P450 19A1


J Med Chem 33: 101-5 (1990)


BindingDB Entry DOI: 10.7270/Q2KP8141
More data for this
Ligand-Target Pair