BDBM50549958 CHEMBL4778131

SMILES CCS(=O)(=O)c1ccc(Cl)cc1N(C)C(=O)[C@@H]1O[C@H](CO)[C@H](O)[C@@H]([C@H]1OC)n1cc(nn1)-c1cc(F)c(F)c(F)c1

InChI Key InChIKey=MEUCYOUPEAATQR-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50549958   

TargetLysine-specific demethylase 5A(Human)
Bristol-Myers Squibb

US Patent
LigandPNGBDBM50549958(CHEMBL4778131 | US12269819, Example 23)
Affinity DataIC50: 26nMAssay Description:The Gal-3 assays were performed in 384 white Opti plates in three replicates at room temperature with gentle shaking at 250-300 rpm From the original...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/22/2025
Entry Details
US Patent

TargetGalectin-3(Human)
Smith, Gambrell & Russell

Curated by ChEMBL
LigandPNGBDBM50549958(CHEMBL4778131 | US12269819, Example 23)
Affinity DataIC50: 26nMAssay Description:Inhibition of recombinant human His6-tagged Galectin-3 preincubated for 30 mins followed by B-ASF addition measured after 1 hr by HTRF assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/23/2022
Entry Details Article
PubMed