BDBM50517464 CHEMBL1234300

SMILES Cc1cc(c(c(c1)Oc2cc(c(c(c2)O)C(=O)OC)C)O)O

InChI Key InChIKey=BLXSEOJIXHWXQJ-UHFFFAOYSA-N

Data  2 KI

PDB links: 1 PDB ID matches this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50517464   

TargetLactoylglutathione lyase(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50517464(CHEMBL1234300)
Affinity DataKi:  230nMAssay Description:Inhibition of human GLO1More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/22/2021
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetLactoylglutathione lyase(Mouse)
Chengdu University

Curated by ChEMBL
LigandPNGBDBM50517464(CHEMBL1234300)
Affinity DataKi:  230nMAssay Description:Competitive inhibition of recombinant mouse His-tagged Glyoxalase-1 using GSH and MGO as substrate by spectrophotometric methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/25/2021
Entry Details Article
PubMedPDB3D3D Structure (crystal)