BDBM31365 MLS000708210::N-[4-(4-o-toluoylpiperazino)phenyl]-piperonylamide::N-[4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]-1,3-benzodioxole-5-carboxamide::N-[4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]-1,3-benzodioxole-5-carboxamide::N-[4-[4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-1,3-benzodioxole-5-carboxamide::SMR000287677::cid_1090053

SMILES O=C(N[C@@H](Cc1ccc(NC(=O)c2c(Cl)cccc2Cl)c2ncccc12)C(=O)O)c1c(F)cccc1F

InChI Key InChIKey=NCHBIUAYGRBGFM-UHFFFAOYSA-N

Data  2 IC50

  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 = 31365   

TargetIntegrin alpha-4/beta-7(Human)
Gilead Sciences

US Patent
LigandChemical structure of BindingDB Monomer ID 31365BDBM31365(US11116760, Example 239)
Affinity DataEC50:  77.9nMAssay Description:HEK293 cells (ATCC) were transiently transfected with recombinant NOS and grown. Cells were trypsinized, resuspended to 5 00,000 cells/mL, and plated...More data for this Ligand-Target Pair
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Date in BDB:
3/23/2026
Entry Details
US Patent