BDBM531368 US20260027108, Compound 48

SMILES CCC1=Cc2ncc(CN3CCN(c4ccc(C(=O)Cc5ccn(C)n5)nc4)CC3)cc2CC1=O

InChI Key InChIKey=KLPXSPWYOSKJHD-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 531368   

TargetPoly [ADP-ribose] polymerase 1(Human)
Haisco Pharmaceutical Group

US Patent
LigandChemical structure of BindingDB Monomer ID 531368BDBM531368(US20260027108, Compound 48)
Affinity DataIC50: 0.350nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/10/2026
Entry Details
US Patent