BDBM784020 5-fluoro-2-(1-(3-(7-fluoro-1- oxo-1,2-dihydroisoquinolin-3- yl)propanoyl)-1,2,3,6- tetrahydropyridin-4- yl)benzonitrile::US12459899, Example 112

SMILES N#Cc1cc(F)ccc1C1=CCN(C(=O)CCc2cc3ccc(F)cc3c(=O)[nH]2)CC1

InChI Key InChIKey=KOQNTHBIILTFOB-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 = 784020   

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

US Patent
LigandChemical structure of BindingDB Monomer ID 784020BDBM784020(5-fluoro-2-(1-(3-(7-fluoro-1- oxo-1,2-dihydroisoqu...)
Affinity DataIC50: 1nMAssay Description:Recombinant Cat D was expressed in CHO cells. The assay buffer for CathepsinD is 0.05 M citrate pH 3.5, 10% DMSO final, 5 mM CHAPS. The Cat D enzyme ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
2/23/2026
Entry Details
US Patent