BDBM50630500 CHEMBL5406384

SMILES Cc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@@H]([C@H]2O)n2cc(nn2)S(=O)(=O)c2ccccc2)cc1

InChI Key InChIKey=BOMSPOXOMYAFKP-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 50630500   

TargetGalectin-3(Human)
Lund University

Curated by ChEMBL
LigandPNGBDBM50630500(CHEMBL5406384)
Affinity DataKd:  7.90E+4nMAssay Description:Binding affinity to wild type Galectin-3 (unknown origin) assessed as dissociation constant by fluorescence polarization assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/20/2024
Entry Details
PubMed
TargetGalectin-3(Human)
Lund University

Curated by ChEMBL
LigandPNGBDBM50630500(CHEMBL5406384)
Affinity DataKd:  6.00E+5nMAssay Description:Binding affinity to Galectin-3 R144S mutant (unknown origin) assessed as dissociation constant by fluorescence polarization assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/20/2024
Entry Details
PubMed
TargetGalectin-3(Human)
Lund University

Curated by ChEMBL
LigandPNGBDBM50630500(CHEMBL5406384)
Affinity DataKd:  2.50E+5nMAssay Description:Binding affinity to Galectin-3 R144K mutant (unknown origin) assessed as dissociation constant by fluorescence polarization assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/20/2024
Entry Details
PubMed