BDBM50501887 CHEMBL4454043

SMILES [O-]S(=O)(=O)Oc1cc(OCCCOc2cc(ccc2OS([O-])(=O)=O)-c2oc3cc(OS([O-])(=O)=O)cc(OCCCOc4cc(OS([O-])(=O)=O)cc5oc(-c6ccc(OS([O-])(=O)=O)c(OS([O-])(=O)=O)c6)c(OS([O-])(=O)=O)c(=O)c45)c3c(=O)c2OS([O-])(=O)=O)c2c(c1)oc(-c1ccc(OS([O-])(=O)=O)c(OS([O-])(=O)=O)c1)c(OS([O-])(=O)=O)c2=O

InChI Key InChIKey=XLMNTVYXGAYWRO-UHFFFAOYSA-C

Data  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 1 hit for monomerid = 50501887   

TargetNeutrophil elastase(Human)
Virginia Commonwealth University

Curated by ChEMBL
LigandPNGBDBM50501887(CHEMBL4454043)
Affinity DataIC50: 2.19E+3nMAssay Description:Inhibition of human neutrophil elastase using S1384 as substrate preincubated for 5 mins followed by substrate additionMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/17/2021
Entry Details Article
PubMed