null

SMILES Cl.CCOC(=O)[C@@H](Cc1cn(C)c2ccccc12)NC(=O)[C@@H](N)CC(C)C

InChI Key

  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 13 hits for monomerid = 50576849   

TargetCytochrome P450 3A4(Homo sapiens (Human))TBA
LigandPNGBDBM50576849(CHEMBL4876008)copy SMILES
Affinity DataIC50: 5.00E+3nMAssay Description:Direct inhibition of CYP3A4 in human hepatocytesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XP78Q8PubMed
TargetCytochrome P450 2D6(Homo sapiens (Human))TBA
LigandPNGBDBM50576849(CHEMBL4876008)copy SMILES
Affinity DataIC50: 1.90E+4nMAssay Description:Inhibition of CYP2D6 in human hepatocytesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XP78Q8PubMed
TargetCytochrome P450 2C19(Homo sapiens (Human))TBA
LigandPNGBDBM50576849(CHEMBL4876008)copy SMILES
Affinity DataIC50: 4.70E+4nMAssay Description:Inhibition of CYP2C19 in human hepatocytesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XP78Q8PubMed
TargetCytochrome P450 1A2(Homo sapiens (Human))TBA
LigandPNGBDBM50576849(CHEMBL4876008)copy SMILES
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of CYP1A2 in human hepatocytesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XP78Q8PubMed
TargetCytochrome P450 2B6(Homo sapiens (Human))TBA
LigandPNGBDBM50576849(CHEMBL4876008)copy SMILES
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of CYP2B6 in human hepatocytesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XP78Q8PubMed
TargetCytochrome P450 2C8(Homo sapiens (Human))TBA
LigandPNGBDBM50576849(CHEMBL4876008)copy SMILES
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of CYP2C8 in human hepatocytesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XP78Q8PubMed
TargetPOU domain, class 2, transcription factor 2(Homo sapiens (Human))TBA
LigandPNGBDBM50576849(CHEMBL4876008)copy SMILES
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of OCT2 (unknown origin) expressed in HEK293 cellsMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XP78Q8PubMed
LigandPNGBDBM50576849(CHEMBL4876008)copy SMILES
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of OATP1B1 (unknown origin) expressed in HEK293 cellsMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XP78Q8PubMed
LigandPNGBDBM50576849(CHEMBL4876008)copy SMILES
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of OATP1B3 (unknown origin) expressed in HEK293 cellsMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XP78Q8PubMed
TargetSolute carrier family 22 member 6(Homo sapiens (Human))TBA
LigandPNGBDBM50576849(CHEMBL4876008)copy SMILES
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of OAT1 (unknown origin) expressed in HEK293 cellsMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XP78Q8PubMed
TargetSolute carrier family 22 member 6(Homo sapiens (Human))TBA
LigandPNGBDBM50576849(CHEMBL4876008)copy SMILES
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of OAT3 (unknown origin) expressed in HEK293 cellsMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XP78Q8PubMed
TargetPOU domain, class 2, transcription factor 1(Homo sapiens (Human))TBA
LigandPNGBDBM50576849(CHEMBL4876008)copy SMILES
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of OCT1 (unknown origin) expressed in HEK293 cellsMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XP78Q8PubMed
TargetCytochrome P450 2C9(Homo sapiens (Human))TBA
LigandPNGBDBM50576849(CHEMBL4876008)copy SMILES
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of CYP2C9 in human hepatocytesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XP78Q8PubMed