BDBM50647936 CHEMBL5598417

SMILES CC(C)(C)OC(=O)[C@@H]1C[C@@H](N=C=S)C=C[C@@]12C(=O)N(C(=O)OCc1ccccc1)c1cc(F)c(F)cc12

InChI Key InChIKey=HDDATYUEPXHVTO-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50647936   

TargetCaspase-1(Human)
Chinese Academy of Sciences

Curated by ChEMBL
LigandPNGBDBM50647936(CHEMBL5598417)
Affinity DataIC50: 4.36E+4nMMore data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
10/12/2025
Entry Details
PubMed