BDBM79845 MLS000579747::N-[(E)-2-(3-bromophenyl)-1-(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)ethenyl]benzamide::N-[(E)-2-(3-bromophenyl)-1-(5-thioxo-1,2-dihydro-1,2,4-triazol-3-yl)vinyl]benzamide::N-[2-(3-bromophenyl)-1-(5-mercapto-4H-1,2,4-triazol-3-yl)vinyl]benzamide::SMR000186480::cid_5723855

SMILES CN(CC1CCCCC1)C(=O)c1ccc(-c2ccc(F)cc2C2CC2)cc1S(C)(=O)=O

InChI Key InChIKey=OZKRGJQUQCJBGZ-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 = 79845   

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

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 79845BDBM79845(US20250388560, Compound 41)
Affinity DataKd:  55nMAssay 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