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BDBM50011755 1-(4-Amino-phenyl)-3-aza-bicyclo[3.1.1]heptane-2,4-dione::CHEMBL26543

SMILES: Nc1ccc(cc1)C12CC(C1)C(=O)NC2=O

InChI Key: InChIKey=CZWGXZRCYVSEOA-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50011755   
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))
BDBM50011755
PNG
(1-(4-Amino-phenyl)-3-aza-bicyclo[3.1.1]heptane-2,4...)
Show SMILES Nc1ccc(cc1)C12CC(C1)C(=O)NC2=O |(8.22,.27,;6.89,-.5,;5.54,.28,;4.2,-.47,;4.21,-2.01,;5.54,-2.8,;6.88,-2.04,;2.88,-2.78,;1.55,-2.01,;.23,-2.78,;1.56,-3.55,;.23,-4.32,;-1.11,-5.09,;1.55,-5.09,;2.88,-4.32,;4.21,-5.09,)|
Show InChI InChI=1S/C12H12N2O2/c13-9-3-1-8(2-4-9)12-5-7(6-12)10(15)14-11(12)16/h1-4,7H,5-6,13H2,(H,14,15,16)
PDB
MMDB

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PubMed
n/an/a 2.00E+3n/an/an/an/an/an/a



CIBA-GEIGY AG.

Curated by ChEMBL


Assay Description
In vitro inhibition of human placental Cytochrome P450 19A aromatase


J Med Chem 34: 1329-34 (1991)


BindingDB Entry DOI: 10.7270/Q2QN65RW
More data for this
Ligand-Target Pair