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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Aromatase (CYP19)' and Ligand = 'BDBM50003133'   
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 (CYP19)


(Homo sapiens (human))
BDBM50003133
PNG
(3-Ethyl-5-methyl-4,5-dihydro-3H-[3,4']bipyridinyl-...)
Show SMILES CC[C@@]1(C[C@H](C)C(=O)NC1=O)c1ccncc1
Show InChI InChI=1S/C13H16N2O2/c1-3-13(10-4-6-14-7-5-10)8-9(2)11(16)15-12(13)17/h4-7,9H,3,8H2,1-2H3,(H,15,16,17)/t9-,13+/m0/s1
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MMDB

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PC sid
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Similars

Article
PubMed
n/an/a 2.30E+4n/an/an/an/an/an/a



Institute of Cancer Research

Curated by ChEMBL


Assay Description
Inhibition of Cytochrome P450 19A1


J Med Chem 35: 3699-704 (1992)


Article DOI: 10.1021/jm00098a016
BindingDB Entry DOI: 10.7270/Q2MW2G2M
More data for this
Ligand-Target Pair