BDBM50249337 CHEMBL4099515

SMILES CC(C)c1ccc(Cn2cc(\C=C3/SC(=O)NC3=O)c3ccccc23)cc1

InChI Key InChIKey=QGPCXXWJJVJEAW-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 50249337   

TargetPoly [ADP-ribose] polymerase 1(Human)
Punjabi University

Curated by ChEMBL
LigandPNGBDBM50249337(CHEMBL4099515)
Affinity DataIC50: 740nMAssay Description:Inhibition of PARP1 (unknown origin) using activated DNA as substrate measured after 60 mins in presence of biotinylated NAD by colorimetric assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/17/2019
Entry Details Article
PubMed
TargetPoly [ADP-ribose] polymerase 1(Human)
Punjabi University

Curated by ChEMBL
LigandPNGBDBM50249337(CHEMBL4099515)
Affinity DataIC50: 7.40E+4nMAssay Description:Inhibition of PARP1 (unknown origin) using Strep-HRP as substrate preincubated for 60 mins followed by compound wash and substrate addition and measu...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/2/2021
Entry Details Article
PubMed