BDBM50247510 CHEMBL4068730

SMILES Cc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@@H]([C@H]2O)n2cc(nn2)-c2cc(F)cc(F)c2)cc1

InChI Key InChIKey=QACLTXLGBFUVST-IFLJBQAJSA-N

Data  2 Kd

PDB links: 1 PDB ID matches this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50247510   

TargetGalectin-1(Homo sapiens (Human))
Lund University

Curated by ChEMBL
LigandPNGBDBM50247510(CHEMBL4068730)
Affinity DataKd:  2.90E+5nMAssay Description:Displacement of 3,3'-dideoxy-3-[4-(fluorescein-5-yl-carbonylaminomethyl)-1H-1,2,3-triazol-1-yl]-3'-(3,5-dimethoxy-benzamido)-1,1'-sulfanediyl-di-beta...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetGalectin-3(Homo sapiens (Human))
Lund University

Curated by ChEMBL
LigandPNGBDBM50247510(CHEMBL4068730)
Affinity DataKd:  1.50E+4nMAssay Description:Displacement of 3,3'-dideoxy-3-[4-(fluorescein-5-yl-carbonylaminomethyl)-1H-1,2,3-triazol-1-yl]-3'-(3,5-dimethoxybenzamido)-1,1'-sulfanediyl-di-beta-...More data for this Ligand-Target Pair