BDBM50353229 CHEMBL1830397

SMILES CN(C)CC(C)(C)Cn1c(CC(C)(C)C)nc2cc(\C=C\C(=O)NO)ccc12

InChI Key InChIKey=FDURBWFXDKGGLQ-PKNBQFBNSA-N

Data  11 KI  7 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 7 hits for monomerid = 50353229   

TargetCytochrome P450 2D6(Homo sapiens (Human))
S*Bio

Curated by ChEMBL
LigandPNGBDBM50353229(CHEMBL1830397)
Affinity DataIC50:  1.39E+4nMAssay Description:Inhibition of recombinant CYP2D6 after 30 mins by fluorescence assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 3A4(Homo sapiens (Human))
S*Bio

Curated by ChEMBL
LigandPNGBDBM50353229(CHEMBL1830397)
Affinity DataIC50: >2.50E+4nMAssay Description:Inhibition of CYP3A4 in human liver microsomes by fluorescence assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 2C19(Homo sapiens (Human))
S*Bio

Curated by ChEMBL
LigandPNGBDBM50353229(CHEMBL1830397)
Affinity DataIC50:  8.10E+3nMAssay Description:Inhibition of CYP2C19 in human liver microsomes by fluorescence assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 2C9(Homo sapiens (Human))
S*Bio

Curated by ChEMBL
LigandPNGBDBM50353229(CHEMBL1830397)
Affinity DataIC50: >2.50E+4nMAssay Description:Inhibition of CYP2C9 in human liver microsomes by fluorescence assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetHistone deacetylase 1(Homo sapiens (Human))
S*Bio

Curated by ChEMBL
LigandPNGBDBM50353229(CHEMBL1830397)
Affinity DataIC50:  46nMAssay Description:Inhibition of full length recombinant HDAC1 using Fluor de Lys as substrate by fluorescence assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 2D6(Homo sapiens (Human))
S*Bio

Curated by ChEMBL
LigandPNGBDBM50353229(CHEMBL1830397)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of recombinant CYP2D6 after 30 mins by fluorescence assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 3A4(Homo sapiens (Human))
S*Bio

Curated by ChEMBL
LigandPNGBDBM50353229(CHEMBL1830397)
Affinity DataIC50:  2.28E+3nMAssay Description:Inhibition of recombinant CYP3A4 after 30 mins by fluorescence assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed