BDBM50542716 CHEMBL4638872

SMILES CC1CCN(CC1)c1ccc(NC(=O)c2ccc(CN3CCOCC3)cc2)cc1C(F)(F)F

InChI Key InChIKey=VVJSZYWIEBDKTC-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 50542716   

TargetCytochrome P450 2C9(Human)
University of Illinois At Chicago

Curated by ChEMBL
LigandPNGBDBM50542716(CHEMBL4638872)
Affinity DataIC50: 4.98E+3nMAssay Description:Inhibition of recombinant human CYP2C9 expressed in baculovirus infected insect cell microsomes using fluorescent substrate in presence of NADPH by f...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/13/2021
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
University of Illinois At Chicago

Curated by ChEMBL
LigandPNGBDBM50542716(CHEMBL4638872)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of recombinant human CYP3A4 expressed in baculovirus infected insect cell microsomes using fluorescent substrate in presence of NADPH by f...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/13/2021
Entry Details Article
PubMed