BDBM50661637 CHEMBL6162191

SMILES COc1cccc(-c2cc(Nc3cc(CN4CCN(C(=O)c5cc(Cc6n[nH]c(=O)c7ccccc67)ccc5F)CC4)ccn3)ncn2)c1

InChI Key InChIKey=OOZGSJJFLBJACU-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 = 50661637   

TargetPoly [ADP-ribose] polymerase 1(Human)
South China University of Technology

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50661637BDBM50661637(CHEMBL6162191)
Affinity DataIC50: 10nMAssay Description:Inhibition of PARP1 (unknown origin) incubated for 1 hr by ELISAMore data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
TargetCyclin-dependent kinase 9(Human)
South China University of Technology

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50661637BDBM50661637(CHEMBL6162191)
Affinity DataIC50: 45nMAssay Description:Inhibition of CDK9 (unknown origin) using lipid substrate incubated for 40 mins in presence of ATP by kinase-Glo plus luminescence assayMore data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed