BDBM79804 (3,5-dimethyl-1,2-oxazol-4-yl)methyl 9,10,10-trioxothioxanthene-3-carboxylate::(3,5-dimethyl-1,2-oxazol-4-yl)methyl 9,10,10-tris(oxidanylidene)thioxanthene-3-carboxylate::9,10,10-triketothioxanthene-3-carboxylic acid (3,5-dimethylisoxazol-4-yl)methyl ester::9,10,10-trioxo-3-thioxanthenecarboxylic acid (3,5-dimethyl-4-isoxazolyl)methyl ester::MLS000098705::SMR000063751::cid_2124414

SMILES CSc1ccccc1-c1ccc(C(=O)N(C)CC2CCOC2)c(S(C)(=O)=O)c1

InChI Key InChIKey=MTCDQQWJRCDICU-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 = 79804   

TargetE3 ubiquitin-protein ligase TRIM21(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 79804BDBM79804(US20250388560, Compound 15)
Affinity DataKd:  550nMAssay Description:Keywords: apoptosis, BH3 domain, Bcl2-A1, BIM, caspase, cancer Primary Collaborator: Todd Golub, Broad Institute, golub@broadinstitute.org Assay Over...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/6/2026
Entry Details
US Patent