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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Cytochrome P450 26A1' and Ligand = 'BDBM50253770'   
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
Cytochrome P450 26A1


(Homo sapiens (Human))
BDBM50253770
PNG
(CHEMBL518482 | [4-(Imidazol-1-yl-phenyl-methyl)-ph...)
Show SMILES N(c1ccc(cc1)C(c1ccccc1)n1ccnc1)c1ccc2ccccc2c1
Show InChI InChI=1S/C26H21N3/c1-2-7-21(8-3-1)26(29-17-16-27-19-29)22-11-13-24(14-12-22)28-25-15-10-20-6-4-5-9-23(20)18-25/h1-19,26,28H
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 500n/an/an/an/an/an/a



Cardiff University

Curated by ChEMBL


Assay Description
Inhibition of CYP26A1 in human MCF7 cells


Bioorg Med Chem 16: 8301-13 (2008)


Article DOI: 10.1016/j.bmc.2007.06.048
BindingDB Entry DOI: 10.7270/Q2M61M5B
More data for this
Ligand-Target Pair
Cytochrome P450 26A1


(Homo sapiens (Human))
BDBM50253770
PNG
(CHEMBL518482 | [4-(Imidazol-1-yl-phenyl-methyl)-ph...)
Show SMILES N(c1ccc(cc1)C(c1ccccc1)n1ccnc1)c1ccc2ccccc2c1
Show InChI InChI=1S/C26H21N3/c1-2-7-21(8-3-1)26(29-17-16-27-19-29)22-11-13-24(14-12-22)28-25-15-10-20-6-4-5-9-23(20)18-25/h1-19,26,28H
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 500n/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