BDBM50272148 3-(((2S,3R,4S,5R,6R)-2-((2R,3S,4R,5R,6R)-5-acetamido-4-hydroxy-2-(hydroxymethyl)-6-methoxy-tetrahydro-2H-pyran-3-yloxy)-3,5-dihydroxy-6-(hydroxymethyl)-tetrahydro-2H-pyran-4-yl)carbamoyl)-2-naphthoic acid::CHEMBL502911

SMILES CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](NC(=O)c3cc4ccccc4cc3C(O)=O)[C@H]2O)[C@H](O)[C@H]1NC(C)=O

InChI Key InChIKey=WIEFHIBLMANWPE-UHFFFAOYSA-N

Data  1 Kd

  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 = 50272148   

TargetGalectin-3(Human)
University of Montreal

Curated by ChEMBL
LigandPNGBDBM50272148(3-(((2S,3R,4S,5R,6R)-2-((2R,3S,4R,5R,6R)-5-acetami...)
Affinity DataKd:  300nMAssay Description:Binding affinity to galectin 3More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/17/2012
Entry Details Article
PubMed