BDBM50197859 4-butyl-N-(3-methyl-2,3,4,5-tetrahydro-1H-benzo[d]azepin-7-yl)benzenesulfonamide::CHEMBL231334

SMILES CCCCc1ccc(cc1)S(=O)(=O)Nc1ccc2CCN(C)CCc2c1

InChI Key InChIKey=GGAQZJOAVWSKSS-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:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50197859   

TargetCytochrome P450 3A4(Human)
Uk. Vinc

Curated by ChEMBL
LigandPNGBDBM50197859(4-butyl-N-(3-methyl-2,3,4,5-tetrahydro-1H-benzo[d]...)
Affinity DataIC50: 1.20E+4nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetCytochrome P450 2C9(Human)
Uk. Vinc

Curated by ChEMBL
LigandPNGBDBM50197859(4-butyl-N-(3-methyl-2,3,4,5-tetrahydro-1H-benzo[d]...)
Affinity DataIC50: 4.70E+4nMAssay Description:Inhibition of CYP2C9More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
Uk. Vinc

Curated by ChEMBL
LigandPNGBDBM50197859(4-butyl-N-(3-methyl-2,3,4,5-tetrahydro-1H-benzo[d]...)
Affinity DataIC50: 1.60E+3nMAssay Description:Inhibition of CYP2D6More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetCytochrome P450 2C19(Human)
Uk. Vinc

Curated by ChEMBL
LigandPNGBDBM50197859(4-butyl-N-(3-methyl-2,3,4,5-tetrahydro-1H-benzo[d]...)
Affinity DataIC50: 500nMAssay Description:Inhibition of CYP2C19More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetCytochrome P450 1A2(Human)
Uk. Vinc

Curated by ChEMBL
LigandPNGBDBM50197859(4-butyl-N-(3-methyl-2,3,4,5-tetrahydro-1H-benzo[d]...)
Affinity DataIC50: 2.30E+4nMAssay Description:Inhibition of CYP1A2More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed