BDBM114408 2-(7-chloranylquinolin-4-yl)sulfanylethanoic acid::2-(7-chloroquinolin-4-yl)sulfanylacetic acid::2-[(7-chloro-4-quinolinyl)sulfanyl]acetic acid::2-[(7-chloro-4-quinolinyl)thio]acetic acid::2-[(7-chloro-4-quinolyl)thio]acetic acid::MLS000850622::SMR000456640::cid_224672

SMILES OC(=O)CSc1ccnc2cc(Cl)ccc12

InChI Key InChIKey=YFWVKWISZZSPFR-UHFFFAOYSA-N

Data  5 IC50  3 Kd

  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 8 hits for monomerid = 114408   

TargetMajor prion protein(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM114408(2-(7-chloranylquinolin-4-yl)sulfanylethanoic acid ...)
Affinity DataIC50:  4.04E+3nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetMetallo-beta-lactamase VIM-2(Pseudomonas aeruginosa (g-Proteobacteria))
Uit The Arctic University Of Norway

Curated by ChEMBL
LigandPNGBDBM114408(2-(7-chloranylquinolin-4-yl)sulfanylethanoic acid ...)
Affinity DataIC50:  2.05E+5nMAssay Description:Inhibition of Pseudomonas aeruginosa 301-5473 metallo-beta-lactamase VIM-2 expressed in Escherichia coli BL21(DE3) using nitrocefin as substrate prei...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetMetallo-beta-lactamase VIM-2(Pseudomonas aeruginosa (g-Proteobacteria))
Uit The Arctic University Of Norway

Curated by ChEMBL
LigandPNGBDBM114408(2-(7-chloranylquinolin-4-yl)sulfanylethanoic acid ...)
Affinity DataKd:  2.64E+5nMAssay Description:Binding affinity to Pseudomonas aeruginosa 301-5473 metallo-beta-lactamase VIM-2 expressed in Escherichia coli BL21(DE3) measured for 15 secs by SPR ...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetBeta-lactamase(Klebsiella pneumoniae)
Uit The Arctic University Of Norway

Curated by ChEMBL
LigandPNGBDBM114408(2-(7-chloranylquinolin-4-yl)sulfanylethanoic acid ...)
Affinity DataIC50:  2.20E+5nMAssay Description:Inhibition of native signal containing Klebsiella pneumoniae OXA-48 using nitrocefin substrate pre-incubated for 5 mins before substrate additionMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetMetallo-beta-lactamase type 2(Klebsiella pneumoniae)
Uit The Arctic University Of Norway

Curated by ChEMBL
LigandPNGBDBM114408(2-(7-chloranylquinolin-4-yl)sulfanylethanoic acid ...)
Affinity DataKd:  8.04E+5nMAssay Description:Binding affinity to His-tagged Klebsiella pneumoniae NDM-1 expressed in Escherichia coli BL21-AI cells by surface plasmon resonance assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetMetallo-beta-lactamase type 2(Klebsiella pneumoniae)
Uit The Arctic University Of Norway

Curated by ChEMBL
LigandPNGBDBM114408(2-(7-chloranylquinolin-4-yl)sulfanylethanoic acid ...)
Affinity DataKd:  7.94E+5nMAssay Description:Binding affinity to His-tagged Klebsiella pneumoniae NDM-1 expressed in Escherichia coli BL21-AI cells by surface plasmon resonance assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetMetallo-beta-lactamase type 2(Klebsiella pneumoniae)
Uit The Arctic University Of Norway

Curated by ChEMBL
LigandPNGBDBM114408(2-(7-chloranylquinolin-4-yl)sulfanylethanoic acid ...)
Affinity DataIC50:  1.23E+6nMAssay Description:Inhibition of His-tagged Klebsiella pneumoniae NDM-1 expressed in Escherichia coli BL21-AI cells using imipinem as substrateMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetMetallo-beta-lactamase type 2(Klebsiella pneumoniae)
Uit The Arctic University Of Norway

Curated by ChEMBL
LigandPNGBDBM114408(2-(7-chloranylquinolin-4-yl)sulfanylethanoic acid ...)
Affinity DataIC50:  1.24E+6nMAssay Description:Inhibition of His-tagged Klebsiella pneumoniae NDM-1 expressed in Escherichia coli BL21-AI cells using imipinem as substrateMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed