BDBM50022084 CHEMBL3298908

SMILES CCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc(cc1)N1CCC(CC1)c1ccc(Cl)cc1

InChI Key InChIKey=NPSUKLHLCCMRQW-UHFFFAOYSA-N

Data  5 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50022084   

TargetCytochrome P450 2C9(Human)
Institut Pasteur Korea

Curated by ChEMBL
LigandPNGBDBM50022084(CHEMBL3298908)
Affinity DataIC50: 260nMAssay Description:Inhibition of recombinant CYP2C9 (unknown origin) by LC/MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/12/2015
Entry Details Article
PubMed
TargetCytochrome P450 2C19(Human)
Institut Pasteur Korea

Curated by ChEMBL
LigandPNGBDBM50022084(CHEMBL3298908)
Affinity DataIC50: 6.77E+3nMAssay Description:Inhibition of recombinant CYP2C19 (unknown origin) by LC/MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/12/2015
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
Institut Pasteur Korea

Curated by ChEMBL
LigandPNGBDBM50022084(CHEMBL3298908)
Affinity DataIC50: 4.00E+4nMAssay Description:Inhibition of recombinant CYP2D6 (unknown origin) by LC/MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/12/2015
Entry Details Article
PubMed
TargetCytochrome P450 1A2(Human)
Institut Pasteur Korea

Curated by ChEMBL
LigandPNGBDBM50022084(CHEMBL3298908)
Affinity DataIC50: 4.00E+4nMAssay Description:Inhibition of recombinant CYP1A2 (unknown origin) by LC/MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/12/2015
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Institut Pasteur Korea

Curated by ChEMBL
LigandPNGBDBM50022084(CHEMBL3298908)
Affinity DataIC50: 4.00E+4nMAssay Description:Inhibition of recombinant CYP3A4 (unknown origin) by LC/MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/12/2015
Entry Details Article
PubMed