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Literature summary for 3.1.1.7 extracted from
- Insect-specific irreversible inhibitors of acetylcholinesterase in pests including the bed bug, the eastern yellowjacket, German and American cockroaches, and the confused flour beetle (2010), Chem. Biol. Interact., 187, 142-147.
Inhibitors
| Inhibitors | Comment | Organism | Structure |
|---|---|---|---|
| N,N,N-trimethyl-17-(methylsulfonylthio)heptadecan-1-aminium bromide | i.e. AMTS17, a Cys-targeting methanethiosulfonate molecule, causes over 80% irreversible inhibition, under conditions that spare the human enzyme | Aedes aegypti |  |
| N,N,N-trimethyl-17-(methylsulfonylthio)heptadecan-1-aminium bromide | i.e. AMTS17, a Cys-targeting methanethiosulfonate molecule, causes 95% irreversible inhibition, under conditions that spare the human enzyme | Anopheles gambiae | |
| N,N,N-trimethyl-17-(methylsulfonylthio)heptadecan-1-aminium bromide | i.e. AMTS17, a Cys-targeting methanethiosulfonate molecule, causes irreversible inhibition, under conditions that spare the human enzyme | Blattella germanica | |
| N,N,N-trimethyl-17-(methylsulfonylthio)heptadecan-1-aminium bromide | i.e. AMTS17, a Cys-targeting methanethiosulfonate molecule, causes irreversible inhibition, under conditions that spare the human enzyme | Cimex lectularius | |
| N,N,N-trimethyl-17-(methylsulfonylthio)heptadecan-1-aminium bromide | i.e. AMTS17, a Cys-targeting methanethiosulfonate molecule, causes over 80% irreversible inhibition, under conditions that spare the human enzyme | Culex pipiens | |
| N,N,N-trimethyl-17-(methylsulfonylthio)heptadecan-1-aminium bromide | i.e. AMTS17, a Cys-targeting methanethiosulfonate molecule, causes irreversible inhibition, under conditions that spare the human enzyme | Harmonia axyridis | |
| N,N,N-trimethyl-17-(methylsulfonylthio)heptadecan-1-aminium bromide | i.e. AMTS17, a Cys-targeting methanethiosulfonate molecule, causes irreversible inhibition, under conditions that spare the human enzyme | Periplaneta americana | |
| N,N,N-trimethyl-17-(methylsulfonylthio)heptadecan-1-aminium bromide | i.e. AMTS17, a Cys-targeting methanethiosulfonate molecule, causes irreversible inhibition, under conditions that spare the human enzyme | Tribolium confusum | |
| N,N,N-trimethyl-17-(methylsulfonylthio)heptadecan-1-aminium bromide | i.e. AMTS17, a Cys-targeting methanethiosulfonate molecule, causes irreversible inhibition, under conditions that spare the human enzyme | Vespula maculifrons | |
| N,N,N-trimethyl-18-(methylsulfonylthio)octadecan-1-aminium bromide | i.e. AMTS18, a Cys-targeting methanethiosulfonate molecule, causes over 80% irreversible inhibition, under conditions that spare the human enzyme | Aedes aegypti | |
| N,N,N-trimethyl-18-(methylsulfonylthio)octadecan-1-aminium bromide | i.e. AMTS18, a Cys-targeting methanethiosulfonate molecule, causes 95% irreversible inhibition, under conditions that spare the human enzyme | Anopheles gambiae | |
| N,N,N-trimethyl-18-(methylsulfonylthio)octadecan-1-aminium bromide | i.e. AMTS18, a Cys-targeting methanethiosulfonate molecule, causes irreversible inhibition, under conditions that spare the human enzyme | Blattella germanica | |
| N,N,N-trimethyl-18-(methylsulfonylthio)octadecan-1-aminium bromide | i.e. AMTS18, a Cys-targeting methanethiosulfonate molecule, causes irreversible inhibition, under conditions that spare the human enzyme | Cimex lectularius | |
| N,N,N-trimethyl-18-(methylsulfonylthio)octadecan-1-aminium bromide | i.e. AMTS18, a Cys-targeting methanethiosulfonate molecule, causes over 80% irreversible inhibition, under conditions that spare the human enzyme | Culex pipiens | |
| N,N,N-trimethyl-18-(methylsulfonylthio)octadecan-1-aminium bromide | i.e. AMTS18, a Cys-targeting methanethiosulfonate molecule, causes irreversible inhibition, under conditions that spare the human enzyme | Harmonia axyridis | |
| N,N,N-trimethyl-18-(methylsulfonylthio)octadecan-1-aminium bromide | i.e. AMTS18, a Cys-targeting methanethiosulfonate molecule, causes irreversible inhibition, under conditions that spare the human enzyme | Periplaneta americana | |
| N,N,N-trimethyl-18-(methylsulfonylthio)octadecan-1-aminium bromide | i.e. AMTS18, a Cys-targeting methanethiosulfonate molecule, causes irreversible inhibition, under conditions that spare the human enzyme | Tribolium confusum | |
| N,N,N-trimethyl-18-(methylsulfonylthio)octadecan-1-aminium bromide | i.e. AMTS18, a Cys-targeting methanethiosulfonate molecule, causes irreversible inhibition, under conditions that spare the human enzyme | Vespula maculifrons | |
Natural Substrates/ Products (Substrates)
| Natural Substrates | Organism | Comment (Nat. Sub.) | Natural Products | Comment (Nat. Pro.) | Rev. | Reac. |
|---|---|---|---|---|---|---|
| acetylcholine + H2O | Aedes aegypti | - |
acetate + choline | - |
? | |
| acetylcholine + H2O | Cimex lectularius | - |
acetate + choline | - |
? | |
| acetylcholine + H2O | Anopheles gambiae | - |
acetate + choline | - |
? | |
| acetylcholine + H2O | Periplaneta americana | - |
acetate + choline | - |
? | |
| acetylcholine + H2O | Culex pipiens | - |
acetate + choline | - |
? | |
| acetylcholine + H2O | Blattella germanica | - |
acetate + choline | - |
? | |
| acetylcholine + H2O | Tribolium confusum | - |
acetate + choline | - |
? | |
| acetylcholine + H2O | Harmonia axyridis | - |
acetate + choline | - |
? | |
| acetylcholine + H2O | Vespula maculifrons | - |
acetate + choline | - |
? | |
| acetylcholine + H2O | Cimex lectularius Bedbug | - |
acetate + choline | - |
? | |
Organism
| Organism | UniProt | Comment | Textmining |
|---|---|---|---|
| Aedes aegypti | - |
yellow fever mosquito | - |
| Anopheles gambiae | - |
Malaria mosquito | - |
| Blattella germanica | - |
German cockroach | - |
| Cimex lectularius | - |
Bedbug | - |
| Cimex lectularius Bedbug | - |
Bedbug | - |
| Culex pipiens | - |
Nothern house mosquito | - |
| Harmonia axyridis | - |
multi-colored Asian ladybird beetle | - |
| Periplaneta americana | - |
American cockroach | - |
| Tribolium confusum | - |
flour beetle | - |
| Vespula maculifrons | - |
- |
- |
Substrates and Products (Substrate)
| Substrates | Comment Substrates | Organism | Products | Comment (Products) | Rev. | Reac. |
|---|---|---|---|---|---|---|
| acetylcholine + H2O | - |
Aedes aegypti | acetate + choline | - |
? | |
| acetylcholine + H2O | - |
Cimex lectularius | acetate + choline | - |
? | |
| acetylcholine + H2O | - |
Anopheles gambiae | acetate + choline | - |
? | |
| acetylcholine + H2O | - |
Periplaneta americana | acetate + choline | - |
? | |
| acetylcholine + H2O | - |
Culex pipiens | acetate + choline | - |
? | |
| acetylcholine + H2O | - |
Blattella germanica | acetate + choline | - |
? | |
| acetylcholine + H2O | - |
Tribolium confusum | acetate + choline | - |
? | |
| acetylcholine + H2O | - |
Harmonia axyridis | acetate + choline | - |
? | |
| acetylcholine + H2O | - |
Vespula maculifrons | acetate + choline | - |
? | |
| acetylcholine + H2O | - |
Cimex lectularius Bedbug | acetate + choline | - |
? | |
Synonyms
| Synonyms | Comment | Organism |
|---|---|---|
| AChE | - |
Aedes aegypti |
| AChE | - |
Cimex lectularius |
| AChE | - |
Anopheles gambiae |
| AChE | - |
Periplaneta americana |
| AChE | - |
Culex pipiens |
| AChE | - |
Blattella germanica |
| AChE | - |
Tribolium confusum |
| AChE | - |
Harmonia axyridis |
| AChE | - |
Vespula maculifrons |
Temperature Optimum [°C]
| Temperature Optimum [°C] | Temperature Optimum Maximum [°C] | Comment | Organism |
|---|---|---|---|
| 22 | - |
assay at room temperature | Aedes aegypti |
| 22 | - |
assay at room temperature | Cimex lectularius |
| 22 | - |
assay at room temperature | Anopheles gambiae |
| 22 | - |
assay at room temperature | Periplaneta americana |
| 22 | - |
assay at room temperature | Culex pipiens |
| 22 | - |
assay at room temperature | Blattella germanica |
| 22 | - |
assay at room temperature | Tribolium confusum |
| 22 | - |
assay at room temperature | Harmonia axyridis |
| 22 | - |
assay at room temperature | Vespula maculifrons |
pH Optimum
| pH Optimum Minimum | pH Optimum Maximum | Comment | Organism |
|---|---|---|---|
| 7.4 | - |
assay at | Aedes aegypti |
| 7.4 | - |
assay at | Cimex lectularius |
| 7.4 | - |
assay at | Anopheles gambiae |
| 7.4 | - |
assay at | Periplaneta americana |
| 7.4 | - |
assay at | Culex pipiens |
| 7.4 | - |
assay at | Blattella germanica |
| 7.4 | - |
assay at | Tribolium confusum |
| 7.4 | - |
assay at | Harmonia axyridis |
| 7.4 | - |
assay at | Vespula maculifrons |
IC50 Value
| IC50 Value | IC50 Value Maximum | Comment | Organism | Inhibitor | Structure |
|---|---|---|---|---|---|
| 0.00127 | - |
pH 7.4, 22°C | Tribolium confusum | N,N,N-trimethyl-17-(methylsulfonylthio)heptadecan-1-aminium bromide | |
| 0.00155 | - |
pH 7.4, 22°C | Tribolium confusum | N,N,N-trimethyl-18-(methylsulfonylthio)octadecan-1-aminium bromide | |
| 0.00516 | 0.00585 | pH 7.4, 22°C | Cimex lectularius | N,N,N-trimethyl-17-(methylsulfonylthio)heptadecan-1-aminium bromide | |
| 0.00563 | - |
pH 7.4, 22°C | Vespula maculifrons | N,N,N-trimethyl-17-(methylsulfonylthio)heptadecan-1-aminium bromide | |
| 0.00611 | 0.00886 | different stages of males, 5th instar larvae and adults, pH 7.4, 22°C, overview | Blattella germanica | N,N,N-trimethyl-17-(methylsulfonylthio)heptadecan-1-aminium bromide | |
| 0.00649 | - |
pH 7.4, 22°C | Harmonia axyridis | N,N,N-trimethyl-17-(methylsulfonylthio)heptadecan-1-aminium bromide | |
| 0.00693 | - |
male 5th instar larva, pH 7.4, 22°C | Blattella germanica | N,N,N-trimethyl-18-(methylsulfonylthio)octadecan-1-aminium bromide | |
| 0.00827 | - |
adult male, pH 7.4, 22°C | Periplaneta americana | N,N,N-trimethyl-17-(methylsulfonylthio)heptadecan-1-aminium bromide | |
| 0.0106 | - |
male 7th instar larva, pH 7.4, 22°C | Periplaneta americana | N,N,N-trimethyl-17-(methylsulfonylthio)heptadecan-1-aminium bromide | |
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