BDBM50033374 CHEMBL3357637

SMILES CCOc1cc2ncnc(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)C(\F)=C\CN(C)C

InChI Key InChIKey=LHHLPNVJMCVRGH-YVNNLAQVSA-N

Data  8 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 8 hits for monomerid = 50033374   

TargetCytochrome P450 2C19(Homo sapiens (Human))
Zhejiang University

Curated by ChEMBL
LigandPNGBDBM50033374(CHEMBL3357637)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of CYP2C19 in human hepatic microsomes after 20 mins by LC/MS/MS methodMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 1A2(Homo sapiens (Human))
Zhejiang University

Curated by ChEMBL
LigandPNGBDBM50033374(CHEMBL3357637)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of CYP1A2 in human hepatic microsomes after 20 mins by LC/MS/MS methodMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 2C9(Homo sapiens (Human))
Zhejiang University

Curated by ChEMBL
LigandPNGBDBM50033374(CHEMBL3357637)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of CYP2C9 in human hepatic microsomes after 20 mins by LC/MS/MS methodMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetReceptor tyrosine-protein kinase erbB-2(Homo sapiens (Human))
Zhejiang University

Curated by ChEMBL
LigandPNGBDBM50033374(CHEMBL3357637)
Affinity DataIC50:  1.40nMAssay Description:Inhibition of wild type HER2 (unknown origin) incubated for 5 mins by HTRF assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 3A4(Homo sapiens (Human))
Zhejiang University

Curated by ChEMBL
LigandPNGBDBM50033374(CHEMBL3357637)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of CYP3A4 in human hepatic microsomes after 20 mins by LC/MS/MS methodMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetEpidermal growth factor receptor(Homo sapiens (Human))
Zhejiang University

Curated by ChEMBL
LigandPNGBDBM50033374(CHEMBL3357637)
Affinity DataIC50:  3.80nMAssay Description:Inhibition of wild type EGFR T790M mutant (unknown origin) incubated for 5 mins by HTRF assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetEpidermal growth factor receptor(Homo sapiens (Human))
Zhejiang University

Curated by ChEMBL
LigandPNGBDBM50033374(CHEMBL3357637)
Affinity DataIC50:  0.180nMAssay Description:Inhibition of wild type EGFR (unknown origin) incubated for 5 mins by HTRF assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 2D6(Homo sapiens (Human))
Zhejiang University

Curated by ChEMBL
LigandPNGBDBM50033374(CHEMBL3357637)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of CYP2D6 in human hepatic microsomes after 20 mins by LC/MS/MS methodMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed