BDBM50535044 CHEMBL4471567

SMILES O[C@@H]1[C@@H](COS(=O)(=O)NC(=O)CCc2c[nH]c3ccccc23)O[C@H]([C@@H]1O)n1cnc2c1ncn1ccnc21

InChI Key InChIKey=QPCNFYXTDYZQFI-UHFFFAOYSA-N

Data  1 Kd

PDB links: 1 PDB ID matches this monomer.

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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 = 50535044   

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

Curated by ChEMBL
LigandPNGBDBM50535044(CHEMBL4471567)
Affinity DataKd:  230nMAssay 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
PubMedPDB3D3D Structure (crystal)