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BDBM50326835 2-(2-Bromobenzyl)-6-methoxy-tetralone::CHEMBL1253946

SMILES: COc1ccc2C(=O)C(Cc3ccccc3Br)CCc2c1

InChI Key: InChIKey=GKGZPFKBDIIBHB-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50326835   
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 P450 24A1


(Homo sapiens (Human))
BDBM50326835
PNG
(2-(2-Bromobenzyl)-6-methoxy-tetralone | CHEMBL1253...)
Show SMILES COc1ccc2C(=O)C(Cc3ccccc3Br)CCc2c1
Show InChI InChI=1S/C18H17BrO2/c1-21-15-8-9-16-12(11-15)6-7-14(18(16)20)10-13-4-2-3-5-17(13)19/h2-5,8-9,11,14H,6-7,10H2,1H3
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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 1.63E+4n/an/an/an/an/an/a



Cardiff University

Curated by ChEMBL


Assay Description
Inhibition of CYP24A1 expressed in CHO cells


Eur J Med Chem 45: 4427-34 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.001
BindingDB Entry DOI: 10.7270/Q2ZW1M4W
More data for this
Ligand-Target Pair
Sterol 26-hydroxylase, mitochondrial


(Homo sapiens (Human))
BDBM50326835
PNG
(2-(2-Bromobenzyl)-6-methoxy-tetralone | CHEMBL1253...)
Show SMILES COc1ccc2C(=O)C(Cc3ccccc3Br)CCc2c1
Show InChI InChI=1S/C18H17BrO2/c1-21-15-8-9-16-12(11-15)6-7-14(18(16)20)10-13-4-2-3-5-17(13)19/h2-5,8-9,11,14H,6-7,10H2,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 59n/an/an/an/an/an/a



Cardiff University

Curated by ChEMBL


Assay Description
Inhibition of CYP27A1 expressed in CHO cells


Eur J Med Chem 45: 4427-34 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.001
BindingDB Entry DOI: 10.7270/Q2ZW1M4W
More data for this
Ligand-Target Pair