BDBM50507464 CHEMBL4438655

SMILES COc1ccc2C(=O)N(CCCNCCS[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3NC(C)=O)C(=O)c3cccc1c23

InChI Key InChIKey=CRSUKZHNUMRQBT-UHFFFAOYSA-N

Data  2 KI

  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 = 50507464   

TargetProtein O-GlcNAcase(Human)
China Agricultural University

Curated by ChEMBL
LigandPNGBDBM50507464(CHEMBL4438655)
Affinity DataKi:  1.60E+3nMAssay Description:Inhibition of recombinant human OGA expressed in Escherichia coli BL21 (DE3) using varying levels of 4-Mu-GlcNAc as substrate preincubated for 10 min...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/19/2021
Entry Details Article
PubMed
TargetBeta-hexosaminidase subunit beta(Human)
China Agricultural University

Curated by ChEMBL
LigandPNGBDBM50507464(CHEMBL4438655)
Affinity DataKi:  2.21E+4nMAssay Description:Inhibition of recombinant human His6-tagged HexB expressed in Pichia pastoris using varying levels of 4-Mu-GlcNAc as substrate preincubated for 10 mi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/19/2021
Entry Details Article
PubMed