BDBM50574686 CHEMBL4854231

SMILES Cc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@H](OCc3cn(nn3)-c3ccccc3C(O)=O)[C@H]2O)cc1

InChI Key InChIKey=ZWAUJWQJMNLHFZ-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 = 50574686   

TargetGalectin-8(Human)
Lund University

Curated by ChEMBL
LigandPNGBDBM50574686(CHEMBL4854231)
Affinity DataKd:  1.20E+6nMAssay Description:Binding affinity to human galactin-8 N terminal domain assessed as dissociation constant by competitive fluorescence polarization assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2022
Entry Details Article
PubMed
TargetGalectin-3(Human)
Lund University

Curated by ChEMBL
LigandPNGBDBM50574686(CHEMBL4854231)
Affinity DataKd:  6.90E+5nMAssay Description:Binding affinity to human galactin-3 assessed as dissociation constant by competitive fluorescence polarization assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2022
Entry Details Article
PubMed