BDBM50535047 CHEMBL4468179

SMILES CCCC(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c1nc(N)[nH]c2=O

InChI Key InChIKey=OJPUJVKBNWJKKU-UHFFFAOYSA-N

Data  1 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50535047   

TargetAdenosine 5'-monophosphoramidase HINT1(Human)
University of Minnesota

Curated by ChEMBL
LigandPNGBDBM50535047(CHEMBL4468179)
Affinity DataKd:  2.90E+3nMAssay Description:Binding affinity to His-tagged human full length HINT1 expressed in Rosetta2 pLysS cells by isothermal titration calorimetric assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/28/2021
Entry Details Article
PubMed