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BDBM50353573 CHEMBL1828655

SMILES: CC(C)(C(c1ccc(Nc2ccc3ccccc3c2)cc1)n1ccnc1)C(N)=O

InChI Key: InChIKey=DHADYTVQZADBKR-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50353573   
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 CYP26A1


(Homo sapiens (Human))
BDBM50353573
PNG
(CHEMBL1828655)
Show SMILES CC(C)(C(c1ccc(Nc2ccc3ccccc3c2)cc1)n1ccnc1)C(N)=O
Show InChI InChI=1S/C24H24N4O/c1-24(2,23(25)29)22(28-14-13-26-16-28)18-8-10-20(11-9-18)27-21-12-7-17-5-3-4-6-19(17)15-21/h3-16,22,27H,1-2H3,(H2,25,29)
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PC sid
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Article
PubMed
n/an/a 50n/an/an/an/an/an/a



Cardiff University

Curated by ChEMBL


Assay Description
Inhibition of human CYP26A1 assessed using [11,12-3H]ATRA as substrate by scintillation counting


J Med Chem 54: 6803-11 (2011)


Article DOI: 10.1021/jm200695m
BindingDB Entry DOI: 10.7270/Q2WM1DSJ
More data for this
Ligand-Target Pair