BDBM50453434 CHEMBL4211628

SMILES OC(Cn1cnnn1)(c1ccc(F)cc1F)C(F)(F)c1ccc(cn1)-c1ccc(OCC(F)(F)F)cc1

InChI Key InChIKey=IDUYJRXRDSPPRC-UHFFFAOYSA-N

Data  5 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 5 hits for monomerid = 50453434   

TargetCytochrome P450 2C19(Human)TBA
LigandChemical structure of BindingDB Monomer ID 50453434BDBM50453434(CHEMBL4211628)
Affinity DataIC50: 8.50E+3nMAssay Description:Inhibition of CYP2C19 in human liver microsomes using mephenytoin as substrate preincubated for 10 mins with substrate followed by NADPH addition mea...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/15/2020
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)TBA
LigandChemical structure of BindingDB Monomer ID 50453434BDBM50453434(CHEMBL4211628)
Affinity DataIC50: 8.70E+3nMAssay Description:Inhibition of CYP2D6 in human liver microsomes using dextromethorphan as substrate preincubated for 10 mins with substrate followed by NADPH addition...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/15/2020
Entry Details Article
PubMed
TargetCytochrome P450 2C9(Human)TBA
LigandChemical structure of BindingDB Monomer ID 50453434BDBM50453434(CHEMBL4211628)
Affinity DataIC50: 1.15E+4nMAssay Description:Inhibition of CYP2C9 in human liver microsomes using tolbutamide as substrate preincubated for 10 mins with substrate followed by NADPH addition meas...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/15/2020
Entry Details Article
PubMed
TargetCytochrome P450 1A2(Human)TBA
LigandChemical structure of BindingDB Monomer ID 50453434BDBM50453434(CHEMBL4211628)
Affinity DataIC50: 2.89E+4nMAssay Description:Inhibition of CYP1A2 in human liver microsomes using phenacetin as substrate preincubated for 10 mins with substrate followed by NADPH addition measu...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/15/2020
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)TBA
LigandChemical structure of BindingDB Monomer ID 50453434BDBM50453434(CHEMBL4211628)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of CYP3A4 in human liver microsomes using midazolam as substrate preincubated for 10 mins with substrate followed by NADPH addition measur...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/15/2020
Entry Details Article
PubMed