BDBM50247629 CHEMBL453384::N-(3-((tert-butylamino)methyl)-4-fluorophenyl)-7-chloroquinolin-4-amine::TCMDC-135909::[3-(tert-Butylaminomethyl)-4-fluorophenyl](7-chloro-quinolin-4-yl)amine

SMILES CC(C)(C)NCc1cc(Nc2ccnc3cc(Cl)ccc23)ccc1F

InChI Key InChIKey=OKGGBPZMSDNNFA-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 = 50247629   

TargetCytochrome P450 2D6(Human)
University of Liverpool

Curated by ChEMBL
LigandPNGBDBM50247629(N-(3-((tert-butylamino)methyl)-4-fluorophenyl)-7-c...)
Affinity DataIC50: 300nMAssay Description:Inhibition of human CYP2D6More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/21/2012
Entry Details Article
PubMed
TargetCytochrome P450 1A2(Human)
University of Liverpool

Curated by ChEMBL
LigandPNGBDBM50247629(N-(3-((tert-butylamino)methyl)-4-fluorophenyl)-7-c...)
Affinity DataIC50: 8.80E+3nMAssay Description:Inhibition of human CYP1A2More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/21/2012
Entry Details Article
PubMed
TargetCytochrome P450 2C8(Human)
University of Liverpool

Curated by ChEMBL
LigandPNGBDBM50247629(N-(3-((tert-butylamino)methyl)-4-fluorophenyl)-7-c...)
Affinity DataIC50: 9.80E+3nMAssay Description:Inhibition of human CYP2C8More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/21/2012
Entry Details Article
PubMed
TargetCytochrome P450 2C9(Human)
University of Liverpool

Curated by ChEMBL
LigandPNGBDBM50247629(N-(3-((tert-butylamino)methyl)-4-fluorophenyl)-7-c...)
Affinity DataIC50: 5.20E+4nMAssay Description:Inhibition of human CYP2C9More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/21/2012
Entry Details Article
PubMed
TargetCytochrome P450 2C19(Human)
University of Liverpool

Curated by ChEMBL
LigandPNGBDBM50247629(N-(3-((tert-butylamino)methyl)-4-fluorophenyl)-7-c...)
Affinity DataIC50: 6.40E+4nMAssay Description:Inhibition of human CYP2C19More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/21/2012
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
University of Liverpool

Curated by ChEMBL
LigandPNGBDBM50247629(N-(3-((tert-butylamino)methyl)-4-fluorophenyl)-7-c...)
Affinity DataIC50: 1.00E+5nMAssay Description:Activation of human CYP3A4 using DEF substrateMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/21/2012
Entry Details Article
PubMed