BDBM50339145 CHEMBL1689063::trans-7-oxo-6-(sulfooxy)-1,6-diazabicyclo[3.2.1]octan-2-carboxamide

SMILES NC(=O)[C@@H]1CC[C@@H]2CN1C(=O)N2OS(O)(=O)=O

InChI Key InChIKey=NDCUAPJVLWFHHB-UHNVWZDZSA-N

Data  4 KI  3 IC50

PDB links: 3 PDB IDs match 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 7 hits for monomerid = 50339145   

TargetCarbapenem-hydrolyzing beta-lactamase KPC()
Qpex Biopharma

Curated by ChEMBL
LigandPNGBDBM50339145(CHEMBL1689063 | trans-7-oxo-6-(sulfooxy)-1,6-diaza...)
Affinity DataKi:  11nMAssay Description:Inhibition of recombinant Escherichia coli KPC-2 using nitrocefin as substrate preincubated for 10 mins followed by substrate addition and measured e...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetOXA23 carbapenemase(Acinetobacter baumannii)
Qpex Biopharma

Curated by ChEMBL
LigandPNGBDBM50339145(CHEMBL1689063 | trans-7-oxo-6-(sulfooxy)-1,6-diaza...)
Affinity DataKi:  1.70E+3nMAssay Description:Inhibition of Acinetobacter baumannii OXA-23 using nitrocefin as substrate preincubated for 10 mins followed by substrate addition measured every 10 ...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetBeta-lactamase(Enterobacter cloacae)
Novexel

Curated by ChEMBL
LigandPNGBDBM50339145(CHEMBL1689063 | trans-7-oxo-6-(sulfooxy)-1,6-diaza...)
Affinity DataKi:  7.70E+3nMAssay Description:Inhibition of Enterobacter cloacae beta-lactamase P99 after 5 seconds incubation with nitrocefin substrate by spectrophotometryMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetVIM-1 metallo-beta-lactamase(Klebsiella pneumoniae)
Qpex Biopharma

Curated by ChEMBL
LigandPNGBDBM50339145(CHEMBL1689063 | trans-7-oxo-6-(sulfooxy)-1,6-diaza...)
Affinity DataKi: >4.00E+4nMAssay Description:Inhibition of recombinant Escherichia coli VIM-1 using nitrocefin as substrate preincubated for 10 mins followed by substrate addition measured every...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetBeta-lactamase(Pseudomonas aeruginosa (PAO1))
Novexel

Curated by ChEMBL
LigandPNGBDBM50339145(CHEMBL1689063 | trans-7-oxo-6-(sulfooxy)-1,6-diaza...)
Affinity DataIC50:  128nMAssay Description:Inhibition of Pseudomonas aeruginosa beta-lactamase AmpC assessed as nitrocefin hydrolysis after 5 mins enzyme-compound preincubationMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetBeta-lactamase TEM(Escherichia coli)
Sichuan University

Curated by ChEMBL
LigandPNGBDBM50339145(CHEMBL1689063 | trans-7-oxo-6-(sulfooxy)-1,6-diaza...)
Affinity DataIC50:  1.90nMAssay Description:Inhibition of bacterial Beta-lactamase TEM-1 (24 - 286) (unknown origin) expressed in Escherichia coli Transetta (DE3)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetBeta-lactamase(Enterobacter cloacae)
Novexel

Curated by ChEMBL
LigandPNGBDBM50339145(CHEMBL1689063 | trans-7-oxo-6-(sulfooxy)-1,6-diaza...)
Affinity DataIC50:  100nMAssay Description:Inhibition of Enterobacter cloacae beta-lactamase P99 assessed as nitrocefin hydrolysis after 5 mins enzyme-compound preincubationMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed