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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Aromatase' and Ligand = 'BDBM50009614'   
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))
BDBM50009614
PNG
(2-Pyridin-4-ylmethyl-3,4-dihydro-2H-naphthalen-1-o...)
Show SMILES O=C1C(Cc2ccncc2)CCc2ccccc12
Show InChI InChI=1S/C16H15NO/c18-16-14(11-12-7-9-17-10-8-12)6-5-13-3-1-2-4-15(13)16/h1-4,7-10,14H,5-6,11H2
PDB
MMDB

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PubMed
n/an/a 4.30E+3n/an/an/an/an/an/a



Universität des Saarlandes

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against Aromatase was determined using [1beta,2beta-3H]testosterone as radioligand


J Med Chem 34: 2685-91 (1991)


BindingDB Entry DOI: 10.7270/Q2ST7NT9
More data for this
Ligand-Target Pair