BDBM37551 MLS000082016::N-[2-(4-methoxyphenyl)ethyl]-2,3-dihydro-1,4-dioxin-5-carboxamide::N-[2-(4-methoxyphenyl)ethyl]-2,3-dihydro-1,4-dioxine-5-carboxamide::N-[2-(4-methoxyphenyl)ethyl]-2,3-dihydro-p-dioxin-5-carboxamide::SMR000061349::cid_2354370

SMILES CC[C@@H](Nc1cc(F)c(C(=O)N[C@@H](Cc2ccc(-c3cc(N(C)C)c(C)n(C)c3=O)c3ncccc23)C(=O)O)c(F)c1)C(F)(F)F

InChI Key InChIKey=VPCDZMHCLKYUMO-UHFFFAOYSA-N

Data  1 IC50  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 = 37551   

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

US Patent
LigandChemical structure of BindingDB Monomer ID 37551BDBM37551(US11116760, Example 268)
Affinity DataEC50:  4.30nMAssay Description:The CHO cell line was cultured in T-175 sq cm Corning flasks (part 431080) at 37 deg C and 95% RH. The HTS assay began by dispensing 10 microliters o...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/23/2026
Entry Details
US Patent