BDBM50619648 CHEMBL2031559

SMILES FC(F)(F)c1cc(C(=O)Nc2cccc(c2)-c2nnn[nH]2)c2nc[nH]c2c1

InChI Key InChIKey=MQJFWUUNKXRFOL-UHFFFAOYSA-N

Data  4 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50619648   

TargetBeta-lactamase(Escherichia coli)
Xihua University

Curated by ChEMBL
LigandPNGBDBM50619648(CHEMBL2031559)
Affinity DataKi:  85nMAssay Description:Binding affinity to Escherichia coli CTX-M-14 assessed as inhibition constant using nitrocefin as substrate by microplate reader analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2024
Entry Details
PubMed
TargetBeta-lactamase(Escherichia coli)
Xihua University

Curated by ChEMBL
LigandPNGBDBM50619648(CHEMBL2031559)
Affinity DataKi:  280nMAssay Description:Binding affinity to Escherichia coli CTX-M-27 assessed as inhibition constant using nitrocefin as substrate by microplate reader analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2024
Entry Details
PubMed
TargetCarbapenem-hydrolyzing beta-lactamase KPC(Klebsiella oxytoca)
Xihua University

Curated by ChEMBL
LigandPNGBDBM50619648(CHEMBL2031559)
Affinity DataKi:  9.73E+4nMAssay Description:Binding affinity to Escherichia coli KPC-2 assessed as inhibition constant using nitrocefin as substrate by microplate reader analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2024
Entry Details
PubMed
TargetBeta-lactamase(Escherichia coli (strain K12))
Xihua University

Curated by ChEMBL
LigandPNGBDBM50619648(CHEMBL2031559)
Affinity DataKi:  3.87E+5nMAssay Description:Binding affinity to Escherichia coli AmpC assessed as inhibition constant using nitrocefin as substrate by microplate reader analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2024
Entry Details
PubMed