BDBM50539925 CHEMBL4633160

SMILES Cc1cc(ccc1C#N)Oc2ccc(cc2)CC(=O)N3CCN(C(=O)C3)C

InChI Key InChIKey=WFOOODRZHBDNTB-UHFFFAOYSA-N

Data  1 Kd

PDB links: 2 PDB IDs match this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50539925   

TargetThiol:disulfide interchange protein DsbA(Escherichia coli (strain K12))
Monash University (Parkville Campus)

Curated by ChEMBL
LigandPNGBDBM50539925(CHEMBL4633160)
Affinity DataKd:  4.80E+5nMAssay Description:Binding affinity to uniformly labeled 15N oxidized Escherichia coli DsbA by 1H-15N HSQC NMR spectroscopyMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/12/2021
Entry Details Article
PubMedPDB3D3D Structure (crystal)