BDBM50003160 CHEMBL435611::[(3-Acetoxymethyl-7-methoxy-5,5,8-trioxo-5lambda*6*-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carbonyl)-benzyl-amino]-acetic acid

SMILES CO[C@@H]1[C@@H]2N(C1=O)C(C(=O)N(CC(O)=O)Cc1ccccc1)=C(COC(C)=O)CS2(=O)=O

InChI Key InChIKey=AYGHAARFEGKZQQ-UHFFFAOYSA-N

Data  1 KI

  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 1 hit for monomerid = 50003160   

TargetNeutrophil elastase(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50003160(CHEMBL435611 | [(3-Acetoxymethyl-7-methoxy-5,5,8-t...)
Affinity DataKi:  6.10E+3nMAssay Description:Inhibitory activity against HLE at 10 min (48 mM conc)More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/23/2012
Entry Details Article
PubMed