BDBM50247475 CHEMBL4071878

SMILES OC[C@H]1O[C@@H](SS[C@@H]2O[C@H](CO)[C@H](O)[C@@H]([C@H]2O)n2cc(nn2)-c2cc(F)c(F)c(F)c2)[C@H](O)[C@H]([C@H]1O)n1cc(CNC(=O)c2ccc3c(c2)C(=O)OC32c3ccc(O)cc3Oc3cc(O)ccc23)nn1

InChI Key InChIKey=AZGKFZMIEHYEIQ-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 50247475   

TargetGalectin-3(Human)
Lund University

Curated by ChEMBL
LigandPNGBDBM50247475(CHEMBL4071878)
Affinity DataKd:  8.70nMAssay Description:Binding affinity to human galectin-3 expressed in Escherichia coli BL21(DE3) in presence of BSA by direct fluorescence polarization titration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/2/2019
Entry Details Article
PubMed
TargetGalectin-1(Human)
Lund University

Curated by ChEMBL
LigandPNGBDBM50247475(CHEMBL4071878)
Affinity DataKd:  500nMAssay Description:Binding affinity to human galectin-1 expressed in Escherichia coli XL1 blue in presence of BSA by direct fluorescence polarization titration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/2/2019
Entry Details Article
PubMed