BDBM50438242 CHEMBL2407972

SMILES CCNC(=O)c1ccc(cc1)N1CCN(Cc2ccc3OC(C)C(=O)Nc3c2)CC1

InChI Key InChIKey=AXPUPLBOXKRYFP-UHFFFAOYSA-N

Data  1 IC50  2 EC50

  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 3 hits for monomerid = 50438242   

TargetPoly [ADP-ribose] polymerase 1(Human)
Takeda California

Curated by ChEMBL
LigandPNGBDBM50438242(CHEMBL2407972)
Affinity DataIC50: 22nMAssay Description:Inhibition of human PARP1 catalytic activity after 10 mins by ELISAMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/13/2014
Entry Details Article
PubMed
TargetPoly [ADP-ribose] polymerase 1(Human)
Takeda California

Curated by ChEMBL
LigandPNGBDBM50438242(CHEMBL2407972)
Affinity DataEC50:  1.50E+4nMAssay Description:Inhibition of PARP1 in human Jurkat cells assessed as reduction of cell viability after 96 hrs by MTS assay in presence of 100 uM of temozolomideMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/13/2014
Entry Details Article
PubMed
TargetPoly [ADP-ribose] polymerase 1(Human)
Takeda California

Curated by ChEMBL
LigandPNGBDBM50438242(CHEMBL2407972)
Affinity DataEC50:  4.20E+4nMAssay Description:Inhibition of PARP1 in human Jurkat cells assessed as reduction of cell viability after 96 hrs by MTS assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/13/2014
Entry Details Article
PubMed