BDBM72908 3-methyl-N-(2-sec-butylphenyl)isoxazole-5-carboxamide::MLS001177323::N-(2-butan-2-ylphenyl)-3-methyl-1,2-oxazole-5-carboxamide::N-(2-butan-2-ylphenyl)-3-methyl-5-isoxazolecarboxamide::SMR000592485::cid_16291880

SMILES COc1cc(C(=O)N2C[C@H](N)C[C@@H](F)C2)cc2nc3n(c12)Cc1cccc(c1)-c1ccccc1CCCCn1c-3cc2ccccc21

InChI Key InChIKey=PBOJDVJGOXHZRS-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 = 72908   

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

US Patent
LigandChemical structure of BindingDB Monomer ID 72908BDBM72908(((3R,5R)-3-amino-5-fluoropiperidin-1l-yl)(27-metho...)
Affinity DataIC50: 191nMAssay 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