BDBM96959 4-(2-{[N-(phenylsulfonyl)glycyl]oxy}acetyl)phenyl benzoate::MLS000576397::SMR000198038::[4-[2-[2-(benzenesulfonamido)acetyl]oxyacetyl]phenyl] benzoate::[4-[2-[2-(phenylsulfonylamino)ethanoyloxy]ethanoyl]phenyl] benzoate::benzoic acid [4-[2-[2-(benzenesulfonamido)-1-oxoethoxy]-1-oxoethyl]phenyl] ester::benzoic acid [4-[2-[2-(benzenesulfonamido)acetyl]oxyacetyl]phenyl] ester::cid_1617983

SMILES COc1ccccc1-c1cc(C)ncc1C(=O)Nc1nnc(OCc2ccc(C#N)cn2)s1

InChI Key InChIKey=BHMAPVKIMGCGQD-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 = 96959   

TargetDNA polymerase theta [1-899](Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 96959BDBM96959(N-(5-((5-cyanopyridin-2-yl)methoxy)- 1,3,4-thiadia...)
Affinity DataIC50: 200nMAssay Description:Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Confirmation testing of small molecules identifie...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/11/2026
Entry Details
US Patent