BDBM50647946 CHEMBL5597123

SMILES COc1ccc2c(c1)[C@]1(C=C[C@H](N=C=S)C[C@H]1C(=O)OC(C)(C)C)C(=O)N2

InChI Key InChIKey=VQTASNFDIKOZRY-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50647946   

TargetCaspase-1(Human)
Chinese Academy of Sciences

Curated by ChEMBL
LigandPNGBDBM50647946(CHEMBL5597123)
Affinity DataIC50: 4.06E+4nMMore data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
10/12/2025
Entry Details
PubMed