BDBM783835 1''-(3-(8-fluoro-5-methyl-1-oxo- 1,2-dihydroisoquinolin-3- yl)propyl)-1'',2'',3'',6''-tetrahydro- [2,4''-bipyridine]-5-carbonitrile::US12459899, Example 57

SMILES Cc1ccc(F)c2c(=O)[nH]c(CCCN3CC=C(c4ccc(C#N)cn4)CC3)cc12

InChI Key

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 783835   

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

US Patent
LigandChemical structure of BindingDB Monomer ID 783835BDBM783835(1'-(3-(8-fluoro-5-methyl-1-oxo- 1,2-dihydroisoquin...)
Affinity DataIC50: 0.650nMAssay 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

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

US Patent
LigandChemical structure of BindingDB Monomer ID 783835BDBM783835(1'-(3-(8-fluoro-5-methyl-1-oxo- 1,2-dihydroisoquin...)
Affinity DataIC50: 0.910nMAssay 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