BDBM783841 5-(4-(3-(7-fluoro-5-methyl-1- oxo-1,2-dihydroisoquinolin-3- yl)propanoyl)piperazin-1- yl)picolinonitrile::US12459899, Example 151

SMILES Cc1cc(F)cc2c(=O)[nH]c(CCC(=O)N3CCN(c4ccc(C#N)nc4)CC3)cc12

InChI Key InChIKey=JCNXXMCTTJGXDU-UHFFFAOYSA-N

  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 = 783841   

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

US Patent
LigandChemical structure of BindingDB Monomer ID 783841BDBM783841(5-(4-(3-(7-fluoro-5-methyl-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

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

US Patent
LigandChemical structure of BindingDB Monomer ID 783841BDBM783841(5-(4-(3-(7-fluoro-5-methyl-1- oxo-1,2-dihydroisoqu...)
Affinity DataIC50: 4.05nMAssay 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