BDBM72928 3-(2-methoxyphenyl)propanoic acid [2-(2,6-dibromo-4-methylanilino)-2-oxoethyl] ester::3-(2-methoxyphenyl)propionic acid [2-(2,6-dibromo-4-methyl-anilino)-2-keto-ethyl] ester::MLS001177455::SMR000590874::[2-(2,6-dibromo-4-methylanilino)-2-oxoethyl] 3-(2-methoxyphenyl)propanoate::[2-[[2,6-bis(bromanyl)-4-methyl-phenyl]amino]-2-oxidanylidene-ethyl] 3-(2-methoxyphenyl)propanoate::cid_3306710

SMILES COc1ccccc1CCC(=O)OCC(=O)Nc1c(Br)cc(C)cc1Br

InChI Key InChIKey=SJKJGDVLRFXUQG-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 = 72928   

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

US Patent
LigandChemical structure of BindingDB Monomer ID 72928BDBM72928(((1R,4R,7R)-7-amino-2-azabicyclo[2.2.1]heptan-2-yl...)
Affinity DataIC50: 26nMAssay 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