BDBM783996 2-fluoro-5-(1-(3-(8-fluoro-1- oxo-1,2-dihydroisoquinolin-3- yl)propanoyl)-1,2,3,6- tetrahydropyridin-4- yl)benzonitrile::US12459899, Example 87

SMILES N#Cc1cc(C2=CCN(C(=O)CCc3cc4cccc(F)c4c(=O)[nH]3)CC2)ccc1F

InChI Key InChIKey=ZESPQZLUCHPUDG-UHFFFAOYSA-N

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 783996   

TargetPoly [ADP-ribose] polymerase 1(Human)
Digmbio

US Patent
LigandChemical structure of BindingDB Monomer ID 783996BDBM783996(2-fluoro-5-(1-(3-(8-fluoro-1- oxo-1,2-dihydroisoqu...)
Affinity DataIC50: 1nMAssay Description:The assay buffer used in this screen is 0.05 M acetate, pH 4.2, 10% DMSO final, 100 uM genapol (which is a nonionic detergent, below its Critical Mic...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
2/23/2026
Entry Details
US Patent