BDBM50538666 CHEMBL4640366

SMILES O=C(CCCCCCC(=O)Nc1ccccc1)NOC(c1ccccc1)(c1ccccc1)c1ccccc1

InChI Key InChIKey=VOZQRPZNBJISMA-UHFFFAOYSA-N

Data  4 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50538666   

TargetCytochrome P450 3A4(Human)
Universidad De Granada

Curated by ChEMBL
LigandPNGBDBM50538666(CHEMBL4640366)
Affinity DataIC50: 5.56E+3nMAssay Description:Inhibition of CYP3A4 in human liver microsomes using testosterone as substrate measured after 15 mins by LC-MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/12/2021
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
Universidad De Granada

Curated by ChEMBL
LigandPNGBDBM50538666(CHEMBL4640366)
Affinity DataIC50: 8.62E+4nMAssay Description:Inhibition of CYP2D6 in human liver microsomes using dextromethorphan as substrate measured after 30 mins by LC-MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/12/2021
Entry Details Article
PubMed
TargetCytochrome P450 2C9(Human)
Universidad De Granada

Curated by ChEMBL
LigandPNGBDBM50538666(CHEMBL4640366)
Affinity DataIC50: 2.52E+3nMAssay Description:Inhibition of CYP2C9 in human liver microsomes using diclofenac as substrate measured after 45 mins by LC-MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/12/2021
Entry Details Article
PubMed
TargetPotassium voltage-gated channel subfamily H member 2(Human)
Universidad De Granada

Curated by ChEMBL
LigandPNGBDBM50538666(CHEMBL4640366)
Affinity DataIC50: 9.62E+4nMAssay Description:Inhibition of human ERG expressed in HEK293 cells measured after 30 mins by FluxOR dye based FLIPR TETRA assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/12/2021
Entry Details Article
PubMed