BDBM50072041 CHEMBL314286::{(S)-1-[(S)-1-((S)-2-Hydroxy-5-oxo-tetrahydro-furan-3-ylcarbamoyl)-ethyl]-2-oxo-azepan-3-yl}-carbamic acid benzyl ester

SMILES C[C@H](N1CCCC[C@H](NC(=O)OCc2ccccc2)C1=O)C(=O)N[C@H]1CC(=O)OC1O

InChI Key InChIKey=DELHARVJPRTCGI-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 50072041   

TargetCaspase-1(Mouse)
Idun Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50072041({(S)-1-[(S)-1-((S)-2-Hydroxy-5-oxo-tetrahydro-fura...)
Affinity DataIC50: 186nMAssay Description:Inhibitory activity against Caspase-1 using Ac-TyrValAlaAsp-amc as substrateMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetCaspase-3(Human)
Idun Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50072041({(S)-1-[(S)-1-((S)-2-Hydroxy-5-oxo-tetrahydro-fura...)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibitory activity against human Caspase-3 using Ac-AspGluValAsp as substrateMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed