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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Aromatase' and Ligand = 'BDBM50014306'   
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))
BDBM50014306
PNG
(1-[2-(4-Chloro-benzyloxy)-2-(2,4-dichloro-phenyl)-...)
Show SMILES Clc1ccc(COC(Cn2cccc2)c2ccc(Cl)cc2Cl)cc1
Show InChI InChI=1S/C19H16Cl3NO/c20-15-5-3-14(4-6-15)13-24-19(12-23-9-1-2-10-23)17-8-7-16(21)11-18(17)22/h1-11,19H,12-13H2
PDB
MMDB

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PC cid
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PubMed
n/an/a 30n/an/an/an/an/an/a



Johns Hopkins University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity for Cytochrome P450 19A1


J Med Chem 33: 2933-42 (1990)


BindingDB Entry DOI: 10.7270/Q2VM4CW9
More data for this
Ligand-Target Pair