BDBM12053 (3S)-3-{[2-(naphthalen-1-yl)benzene]sulfonamido}-4-oxobutanoic acid::(S)-3-(2-Naphthalen-1-yl-benzenesulfonylamino)-4-oxo-butyric acid::arylsulfonamide analogue 17

SMILES OC(=O)C[C@H](NS(=O)(=O)c1ccccc1-c1cccc2ccccc12)C=O

InChI Key InChIKey=GWNHGXUAHVPJPQ-UHFFFAOYSA-N

Data  2 KI  1 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 3 hits for monomerid = 12053   

TargetCaspase-1(Human)
L J University Ahmedabad

Curated by ChEMBL
LigandPNGBDBM12053((3S)-3-{[2-(naphthalen-1-yl)benzene]sulfonamido}-4...)
Affinity DataIC50: 1.14E+4nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/12/2025
Entry Details
PubMed
TargetCaspase-1(Human)
L J University Ahmedabad

Curated by ChEMBL
LigandPNGBDBM12053((3S)-3-{[2-(naphthalen-1-yl)benzene]sulfonamido}-4...)
Affinity DataKi:  6.90E+3nM ΔG°:  -7.32kcal/molepH: 7.0 T: 2°CAssay Description:The substrate peptides terminating in AMC are processed by caspases with or without inhibitors, and the accumulation of AMC was assessed with a Cytof...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/26/2006
Entry Details Article
PubMed
TargetCaspase-1(Human)
L J University Ahmedabad

Curated by ChEMBL
LigandPNGBDBM12053((3S)-3-{[2-(naphthalen-1-yl)benzene]sulfonamido}-4...)
Affinity DataKi:  6.90E+3nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/12/2025
Entry Details
PubMed