BDBM50115621 (2-(thiophen-2-yl)acetamido)methylboronic acid::Acylglycineboronic acid, 11::CHEMBL320049::N-2-THIOPHEN-2-YL-ACETAMIDE BORONIC ACID::N-dihydroxyBoranylmethyl-2-thiophen-2-yl-acetamide

SMILES OB(O)CNC(=O)Cc1cccs1

InChI Key InChIKey=VXAPSUDMBNWYNC-UHFFFAOYSA-N

Data  3 KI

PDB links: 1 PDB ID matches this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50115621   

TargetBeta-lactamase(Escherichia coli)
Northwestern University

LigandPNGBDBM50115621((2-(thiophen-2-yl)acetamido)methylboronic acid | A...)
Affinity DataKi:  320nMpH: 7.0Assay Description:Enzyme inhibition assay using AmpC or TEM-1 from escherichia coli.More data for this Ligand-Target Pair
TargetBeta-lactamase(Escherichia coli)
Northwestern University

LigandPNGBDBM50115621((2-(thiophen-2-yl)acetamido)methylboronic acid | A...)
Affinity DataKi:  320nMAssay Description:Binding affinity of the compound towards AmpC beta-lactamase binding site from Escherichia coliMore data for this Ligand-Target Pair
TargetBeta-lactamase(Staphylococcus aureus)
Northwestern University

LigandPNGBDBM50115621((2-(thiophen-2-yl)acetamido)methylboronic acid | A...)
Affinity DataKi:  6.50E+3nMpH: 7.0Assay Description:Enzyme inhibition assay using AmpC or TEM-1 from escherichia coli.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed