BDBM50191908 CHEMBL441854::benzo[b]thiophene-2-carboxylic acid {(R)-4-[((S)-2-hydroxy-5-oxo-tetrahydro-furan-3-ylcarbamoyl)-methyl]-1,1,5-trioxo-1lambda*6*-[1,4]thiazepan-6-yl}-amide

SMILES OC1OC(=O)C[C@@H]1NC(=O)CN1CCS(=O)(=O)C[C@H](NC(=O)c2cc3ccccc3s2)C1=O

InChI Key InChIKey=SDPSFSZQPDHRKL-CFLSSUJWSA-N

Data  3 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 3 hits for monomerid = 50191908   

TargetCaspase-8(Homo sapiens (Human))
Procter And Gamble Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50191908(CHEMBL441854 | benzo[b]thiophene-2-carboxylic acid...)
Affinity DataIC50:  8.50E+3nMAssay Description:Inhibition of Caspase 8More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCaspase-1(Homo sapiens (Human))
Procter And Gamble Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50191908(CHEMBL441854 | benzo[b]thiophene-2-carboxylic acid...)
Affinity DataIC50:  320nMAssay Description:Inhibition of ICEMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCaspase-3(Homo sapiens (Human))
Procter And Gamble Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50191908(CHEMBL441854 | benzo[b]thiophene-2-carboxylic acid...)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of Caspase 3More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed