BDBM72906 (2-cyanophenyl)methyl 4-oxidanylidenechromene-2-carboxylate::(2-cyanophenyl)methyl 4-oxochromene-2-carboxylate::4-ketochromene-2-carboxylic acid (2-cyanobenzyl) ester::4-oxo-1-benzopyran-2-carboxylic acid (2-cyanophenyl)methyl ester::MLS001176619::SMR000595369::cid_2645940

SMILES COc1cc(C(=O)N2CC3CCC2[C@@H]3N)cc2nc3n(c12)Cc1ccn(n1)-c1ccccc1OCCCn1c-3cc2ccccc21

InChI Key InChIKey=LCSCCQQCJKILBW-UHFFFAOYSA-N

Data  1 EC50

  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 = 72906   

TargetProtein-arginine deiminase type-4(Human)
Bristol-Myers Squibb

US Patent
LigandChemical structure of BindingDB Monomer ID 72906BDBM72906(((7R)-7-amino-2- azabicyclo[2.2.1]heptan-2- yl)((E...)
Affinity DataIC50: 5nMAssay Description:Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/20/2026
Entry Details
US Patent