BDBM50134936 2-(tert-Butylamino-methyl)-5-(7-chloro-quinolin-4-ylamino)-phenol::CHEMBL147806::N-tert-Butyl isoquine

SMILES CC(C)(C)NCc1ccc(Nc2ccnc3cc(Cl)ccc23)cc1O

InChI Key InChIKey=ZVMMVSSEAMUNGI-UHFFFAOYSA-N

Data  6 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 6 hits for monomerid = 50134936   

TargetCytochrome P450 3A4(Human)
University of Liverpool

Curated by ChEMBL
LigandPNGBDBM50134936(N-tert-Butyl isoquine | 2-(tert-Butylamino-methyl)...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of human recombinant CYP3A4 using phenyl-piperazinyl-methyl-benzyl-resofurin as substrateMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/25/2010
Entry Details Article
PubMed
TargetCytochrome P450 1A2(Human)
University of Liverpool

Curated by ChEMBL
LigandPNGBDBM50134936(N-tert-Butyl isoquine | 2-(tert-Butylamino-methyl)...)
Affinity DataIC50: 2.90E+4nMAssay Description:Inhibition of human recombinant CYP1A2More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/25/2010
Entry Details Article
PubMed
TargetCytochrome P450 2C8(Human)
University of Liverpool

Curated by ChEMBL
LigandPNGBDBM50134936(N-tert-Butyl isoquine | 2-(tert-Butylamino-methyl)...)
Affinity DataIC50: 2.30E+4nMAssay Description:Inhibition of human recombinant CYP2C8More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/25/2010
Entry Details Article
PubMed
TargetCytochrome P450 2C19(Human)
University of Liverpool

Curated by ChEMBL
LigandPNGBDBM50134936(N-tert-Butyl isoquine | 2-(tert-Butylamino-methyl)...)
Affinity DataIC50: 2.40E+4nMAssay Description:Inhibition of human recombinant CYP2C19More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/25/2010
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
University of Liverpool

Curated by ChEMBL
LigandPNGBDBM50134936(N-tert-Butyl isoquine | 2-(tert-Butylamino-methyl)...)
Affinity DataIC50: 3.00E+3nMAssay Description:Inhibition of human recombinant CYP2D6More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/25/2010
Entry Details Article
PubMed
TargetPotassium voltage-gated channel subfamily H member 2(Human)
University of Liverpool

Curated by ChEMBL
LigandPNGBDBM50134936(N-tert-Butyl isoquine | 2-(tert-Butylamino-methyl)...)
Affinity DataIC50: 7.50E+3nMAssay Description:Inhibition of human cloned ERGMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/25/2010
Entry Details Article
PubMed