BDBM50191902 CHEMBL214073::isoquinoline-1-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)c2nccc3ccccc23)C1=O

InChI Key InChIKey=ANODMOSBERNBFW-UHFFFAOYSA-N

Data  3 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 = 50191902   

TargetCaspase-1(Human)
Procter and Gamble Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50191902(isoquinoline-1-carboxylic acid {(R)-4-[((S)-2-hydr...)
Affinity DataIC50: 130nMAssay Description:Inhibition of ICEMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/8/2012
Entry Details Article
PubMed
TargetCaspase-8(Human)
Procter and Gamble Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50191902(isoquinoline-1-carboxylic acid {(R)-4-[((S)-2-hydr...)
Affinity DataIC50: 5.00E+3nMAssay Description:Inhibition of Caspase 8More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/8/2012
Entry Details Article
PubMed
TargetCaspase-3(Human)
Procter and Gamble Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50191902(isoquinoline-1-carboxylic acid {(R)-4-[((S)-2-hydr...)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of Caspase 3More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/8/2012
Entry Details Article
PubMed