BDBM50421518 CHEMBL2303759

SMILES COC(=O)CCCCCCCCO[C@@H]1OC(CO)[C@@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@H](O[C@@]3(C[C@@H](O)[C@@H](NC(C)=O)[C@H](O3)C(O)C(O)CO)C(O)=O)[C@@H]2O)[C@@H](O[C@@H]2O[C@H](C)[C@@H](O)[C@H](O)C2O)[C@@H]1NC(C)=O

InChI Key InChIKey=RKTUZGOSPRTQQA-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 50421518   

TargetE-selectin(Human)
Novartis Pharma

Curated by ChEMBL
LigandPNGBDBM50421518(CHEMBL2303759)
Affinity DataIC50: 1.00E+6nMAssay Description:Inhibitory concentration of compound to block the binding of sLE Xto E-selectinMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/4/2012
Entry Details Article
PubMed