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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Aromatase' and Ligand = 'BDBM50041319'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Aromatase


(Homo sapiens (Human))
BDBM50041319
PNG
((E)-5-methoxy-2-(pyridin-4-ylmethylene)-2,3-dihydr...)
Show SMILES COc1ccc2C(=O)\C(Cc2c1)=C\c1ccncc1
Show InChI InChI=1S/C16H13NO2/c1-19-14-2-3-15-12(10-14)9-13(16(15)18)8-11-4-6-17-7-5-11/h2-8,10H,9H2,1H3/b13-8+
PDB
MMDB

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Similars

PubMed
n/an/a 4.80E+3n/an/an/an/an/an/a



Universität des Saarlandes

Curated by ChEMBL


Assay Description
Inhibition of human Placental Cytochrome P450 19A1 in vitro using human placental microsomes and testosterone


J Med Chem 37: 1275-81 (1994)


BindingDB Entry DOI: 10.7270/Q2XD10QX
More data for this
Ligand-Target Pair