Detailed information for compound 283128

Basic information

Technical information
  • TDR Targets ID: 283128
  • Name: 3-methyl-1-nitrosopiperidin-4-one
  • MW: 142.156 | Formula: C6H10N2O2
  • H donors: 0 H acceptors: 2 LogP: 0.22 Rotable bonds: 1
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=NN1CCC(=O)C(C1)C
  • InChi: 1S/C6H10N2O2/c1-5-4-8(7-10)3-2-6(5)9/h5H,2-4H2,1H3
  • InChiKey: OPALKWYJMHLEAL-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 3-methyl-1-nitroso-piperidin-4-one
  • 3-methyl-1-nitroso-4-piperidinone
  • 3-methyl-1-nitroso-4-piperidone
  • 1-nitroso-3-methyl-4-piperidone
  • illimaquinone
  • 71677-48-0
  • 4-Piperidone, 3-methyl-1-nitroso-
  • BRN 1525986
  • CCRIS 5588
  • Nitroso-3-methyl-4-piperidone

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus granulosus metabotropic glutamate receptor 5 0.0048 0.0246 0.0212
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0167 0.1002 0.5111
Entamoeba histolytica hypothetical protein, conserved 0.0167 0.1002 0.523
Schistosoma mansoni hypothetical protein 0.004 0.0191 0.0188
Echinococcus multilocularis Niemann Pick C1 protein 0.0138 0.0818 0.0786
Plasmodium vivax methionine aminopeptidase 1c, putative 0.0167 0.1002 0.089
Onchocerca volvulus 0.0047 0.0238 0.0888
Loa Loa (eye worm) hypothetical protein 0.0015 0.0034 0.0034
Trypanosoma brucei metallo- peptidase, Clan MG, Family M24 0.1571 1 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0286 0.1769 1
Schistosoma mansoni hypothetical protein 0.004 0.0191 0.0188
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0167 0.1002 0.5111
Trypanosoma cruzi hypothetical protein, conserved 0.0253 0.1556 0.0615
Brugia malayi hypothetical protein 0.0232 0.1419 0.1419
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0029 0.0123 0.0106
Trypanosoma cruzi metallo- peptidase, Clan MG, Family M24 0.1571 1 1
Brugia malayi Pre-SET motif family protein 0.0029 0.0123 0.0123
Brugia malayi CHE-14 protein 0.0041 0.02 0.02
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0028 0.0116 0.0082
Schistosoma mansoni survival motor neuron protein 0.0047 0.0238 0.0244
Echinococcus multilocularis methionyl aminopeptidase 1 (M24 family) 0.1571 1 1
Schistosoma mansoni patched 1 0.0041 0.02 0.0199
Echinococcus multilocularis FACT complex subunit SPT16 0.0167 0.1002 0.0971
Echinococcus multilocularis xaa Pro dipeptidase 0.0167 0.1002 0.0971
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0286 0.1769 1
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.0161 0.0127
Echinococcus multilocularis xaa pro aminopeptidase 0.0167 0.1002 0.0971
Echinococcus granulosus xaa pro aminopeptidase 0.0167 0.1002 0.0971
Treponema pallidum methionine aminopeptidase (map) 0.1318 0.838 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0286 0.1769 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0123 0.0106
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0167 0.1002 0.5111
Echinococcus multilocularis expressed conserved protein 0.0091 0.0516 0.0483
Loa Loa (eye worm) latrophilin receptor protein 2 0.0015 0.0034 0.0034
Loa Loa (eye worm) hypothetical protein 0.0232 0.1419 0.1419
Toxoplasma gondii creatinase domain-containing protein 0.0167 0.1002 0.089
Echinococcus multilocularis metabotropic glutamate receptor 5 0.0048 0.0246 0.0212
Plasmodium vivax methionine aminopeptidase 1a, putative 0.1318 0.838 0.836
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0167 0.1002 0.5111
Echinococcus multilocularis methionine aminopeptidase, type I 0.0167 0.1002 0.0971
Entamoeba histolytica Xaa-Pro dipeptidase, putative 0.0167 0.1002 0.523
Schistosoma mansoni hypothetical protein 0.0047 0.0238 0.0244
Wolbachia endosymbiont of Brugia malayi methionine aminopeptidase 0.1318 0.838 1
Brugia malayi metallopeptidase family M24 containing protein 0.0167 0.1002 0.1002
Echinococcus granulosus FACT complex subunit SPT16 0.0167 0.1002 0.0971
Toxoplasma gondii hypothetical protein 0.0253 0.1556 0.1451
Echinococcus granulosus xaa Pro dipeptidase 0.0167 0.1002 0.0971
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0286 0.1769 1
Onchocerca volvulus Methionine aminopeptidase 2 homolog 0.0167 0.1002 0.6771
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0098 0.0563 0.0633
Onchocerca volvulus 0.0167 0.1002 0.6771
Schistosoma mansoni hypothetical protein 0.0033 0.0149 0.0138
Onchocerca volvulus 0.0232 0.1421 1
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0167 0.1002 0.5111
Brugia malayi DNA-binding protein, 42 kDa containing protein 0.0167 0.1002 0.1002
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0123 0.0106
Mycobacterium tuberculosis Methionine aminopeptidase MapA (map) (peptidase M) (MetAP) 0.1318 0.838 1
Echinococcus granulosus Niemann Pick C1 protein 0.0138 0.0818 0.0786
Schistosoma mansoni peptidase 0.0167 0.1002 0.116
Echinococcus granulosus expressed conserved protein 0.0091 0.0516 0.0483
Loa Loa (eye worm) hypothetical protein 0.0167 0.1002 0.1002
Leishmania major hypothetical protein, conserved 0.0253 0.1556 0.0615
Toxoplasma gondii transcriptional elongation factor FACT140 0.0167 0.1002 0.089
Loa Loa (eye worm) hypothetical protein 0.0167 0.1002 0.1002
Loa Loa (eye worm) hypothetical protein 0.0029 0.0123 0.0123
Trypanosoma brucei hypothetical protein, conserved 0.0253 0.1556 0.0615
Plasmodium vivax peptidase, putative 0.0167 0.1002 0.089
Treponema pallidum fructose-bisphosphate aldolase 0.0286 0.1769 0.1039
Schistosoma mansoni hypothetical protein 0.004 0.0191 0.0188
Loa Loa (eye worm) hypothetical protein 0.0051 0.026 0.026
Echinococcus granulosus methionyl aminopeptidase 1 M24 family 0.1571 1 1
Loa Loa (eye worm) hypothetical protein 0.0041 0.02 0.02
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0167 0.1002 0.5111
Loa Loa (eye worm) methionine aminopeptidase type I 0.1571 1 1
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0286 0.1769 1
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0167 0.1002 0.5111
Echinococcus granulosus methionyl aminopeptidase 2 0.0167 0.1002 0.0971
Trichomonas vaginalis set domain proteins, putative 0.0232 0.1421 0.7784
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0286 0.1769 1
Schistosoma mansoni methionyl aminopeptidase 1 (M24 family) 0.1318 0.838 1
Loa Loa (eye worm) glutamate receptor 0.0039 0.0188 0.0188
Echinococcus granulosus xaa Pro dipeptidase 0.0167 0.1002 0.0971
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0167 0.1002 0.5111
Schistosoma mansoni proliferation-associated protein 2G4 38kDa (M24 family) 0.0167 0.1002 0.116
Entamoeba histolytica methionine aminopeptidase, putative 0.0167 0.1002 0.523
Chlamydia trachomatis methionine aminopeptidase 0.1318 0.838 1
Echinococcus granulosus Niemann Pick C1 protein 0.0096 0.0553 0.052
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.0161 0.0127
Mycobacterium tuberculosis Probable cytoplasmic peptidase PepQ 0.0167 0.1002 0.0227
Echinococcus multilocularis Xaa Pro aminopeptidase 3 0.0167 0.1002 0.0971
Schistosoma mansoni metabotropic glutamate receptor 0.0033 0.0147 0.0135
Echinococcus granulosus survival motor neuron protein 1 0.0232 0.1419 0.1389
Schistosoma mansoni aminopeptidase P homologue (M24 family) 0.0167 0.1002 0.116
Toxoplasma gondii methionine aminopeptidase 0.1318 0.838 0.836
Toxoplasma gondii methionine aminopeptidase, type i, putative 0.1318 0.838 0.836
Plasmodium vivax FACT complex subunit SPT16, putative 0.0167 0.1002 0.089
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.0248 0.0248
Schistosoma mansoni hypothetical protein 0.004 0.0191 0.0188
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0286 0.1769 1
Schistosoma mansoni metabotropic glutamate receptor 0.0019 0.0058 0.0029
Plasmodium falciparum HP12 protein homolog, putative 0.0253 0.1556 0.0615
Entamoeba histolytica aminopeptidase, putative 0.0167 0.1002 0.523
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0041 0.02 0.02
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0123 0.0106
Echinococcus granulosus Proliferation associated protein 2G4 0.0167 0.1002 0.0971
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0286 0.1769 1
Schistosoma mansoni proliferation-associated protein 2G4 38kDa (M24 family) 0.0167 0.1002 0.116
Echinococcus granulosus Xaa Pro aminopeptidase 3 0.0167 0.1002 0.0971
Loa Loa (eye worm) initiation factor 2-associated protein 0.0167 0.1002 0.1002
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0167 0.1002 0.5111
Echinococcus granulosus histone lysine methyltransferase setb 0.0029 0.0123 0.0089
Mycobacterium ulcerans methionine aminopeptidase 0.1318 0.838 1
Leishmania major methionine aminopeptidase, putative,metallo-peptidase, Clan MG, Family M24 0.1571 1 1
Loa Loa (eye worm) glutamate receptor 0.0015 0.0035 0.0035
Echinococcus granulosus Protein patched homolog 1 0.0041 0.02 0.0167
Plasmodium falciparum methionine aminopeptidase 1a, putative 0.1318 0.838 0.8199
Brugia malayi latrophilin 2 splice variant baaae 0.0033 0.0149 0.0149
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0167 0.1002 0.5111
Onchocerca volvulus FACT complex subunit SPT16 homolog 0.0167 0.1002 0.6771
Echinococcus multilocularis Niemann Pick C1 protein 0.0096 0.0553 0.052
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.0238 0.0238
Plasmodium vivax methionine aminopeptidase 2, putative 0.0167 0.1002 0.089
Echinococcus multilocularis methionyl aminopeptidase 2 0.0167 0.1002 0.0971
Echinococcus multilocularis Proliferation associated protein 2G4 0.0167 0.1002 0.0971
Toxoplasma gondii proliferation-associated protein 2G4, putative 0.0167 0.1002 0.089
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0167 0.1002 0.5111
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0286 0.1769 1
Brugia malayi Metabotropic glutamate receptor precursor. 0.0039 0.0188 0.0188
Echinococcus multilocularis xaa Pro dipeptidase 0.0167 0.1002 0.0971
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.0096 0.0553 0.2438
Schistosoma mansoni metabotropic glutamate receptor 2 3 (mglur group 2) 0.0045 0.0222 0.0225
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0029 0.0123 0.0089
Giardia lamblia Fructose-bisphosphate aldolase 0.0286 0.1769 1
Loa Loa (eye worm) hypothetical protein 0.0167 0.1002 0.1002
Echinococcus multilocularis sterol regulatory element binding protein 0.0041 0.02 0.0167
Echinococcus multilocularis metabotropic glutamate receptor 2 0.0033 0.0147 0.0113
Schistosoma mansoni hypothetical protein 0.0035 0.0161 0.0152
Schistosoma mansoni Xaa-Pro dipeptidase (M24 family) 0.0167 0.1002 0.116
Loa Loa (eye worm) hypothetical protein 0.0033 0.0149 0.0149
Plasmodium vivax methionine aminopeptidase 1b, putative 0.1571 1 1
Plasmodium vivax proliferation-associated protein 2g4, putative 0.0167 0.1002 0.089
Plasmodium vivax hypothetical protein, conserved 0.0253 0.1556 0.1451
Brugia malayi metallopeptidase family M24 containing protein 0.0167 0.1002 0.1002
Echinococcus multilocularis survival motor neuron protein 1 0.0232 0.1419 0.1389
Onchocerca volvulus Dipeptidase C homolog 0.0167 0.1002 0.6771
Mycobacterium leprae PROBABLE METHIONINE AMINOPEPTIDASE MAPB (MAP) (PEPTIDASE M) 0.1318 0.838 1
Mycobacterium ulcerans cytoplasmic peptidase PepQ 0.0167 0.1002 0.0227
Entamoeba histolytica peptidase, putative 0.0167 0.1002 0.523
Echinococcus multilocularis protein patched 0.0041 0.02 0.0167
Brugia malayi metabotropic glutamate receptor type 2 0.0019 0.0058 0.0058
Schistosoma mansoni aminopeptidase P1 (M24 family) 0.0167 0.1002 0.116
Mycobacterium tuberculosis Methionine aminopeptidase MapB (map) (peptidase M) 0.1318 0.838 1
Trypanosoma cruzi metallo- peptidase, Clan MG, Family M24 0.1571 1 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0286 0.1769 1
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0167 0.1002 0.5111
Schistosoma mansoni methionyl aminopeptidase 1 (M24 family) 0.1318 0.838 1
Toxoplasma gondii peptidase D, putative 0.0167 0.1002 0.089
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0049 0.0248 0.0248
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0167 0.1002 0.5111
Schistosoma mansoni methionyl aminopeptidase 2 (M24 family) 0.0167 0.1002 0.116
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0015 0.0034 0.0034
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.0161 0.0152
Plasmodium falciparum methionine aminopeptidase 1b, putative 0.1571 1 1
Brugia malayi initiation factor 2-associated protein. 0.0167 0.1002 0.1002
Mycobacterium ulcerans aminopeptidase 0.0167 0.1002 0.0227
Loa Loa (eye worm) metallopeptidase family M24 containing protein 0.0167 0.1002 0.1002
Brugia malayi Pre-SET motif family protein 0.0204 0.1241 0.1241
Schistosoma mansoni chromatin-specific transcription elongation factor 140 kDa subunit (M24 family) 0.0167 0.1002 0.116
Toxoplasma gondii methionine aminopeptidase 0.1571 1 1
Brugia malayi Niemann-Pick C1 protein precursor 0.0096 0.0553 0.0553
Mycobacterium tuberculosis Dipeptidase PepE 0.0167 0.1002 0.0227
Brugia malayi hypothetical protein 0.0035 0.0161 0.0161
Echinococcus multilocularis methionyl aminopeptidase 1 (M24 family) 0.1318 0.838 0.8374
Mycobacterium ulcerans dipeptidase PepE 0.0167 0.1002 0.0227
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.0248 0.0248
Brugia malayi Latrophilin receptor protein 2 0.0015 0.0034 0.0034
Loa Loa (eye worm) DNA-binding protein 0.0167 0.1002 0.1002
Mycobacterium leprae Probable cytoplasmic peptidase PepQ 0.0167 0.1002 0.0227
Echinococcus granulosus methionine aminopeptidase type I 0.0167 0.1002 0.0971
Trypanosoma brucei methionine aminopeptidase, type I, putative 0.1571 1 1
Echinococcus granulosus sterol regulatory element binding protein 0.0041 0.02 0.0167
Echinococcus granulosus metabotropic glutamate receptor 2 0.0033 0.0147 0.0113
Mycobacterium ulcerans dipeptidase 0.0167 0.1002 0.0227
Loa Loa (eye worm) hypothetical protein 0.0049 0.0248 0.0248
Brugia malayi metallopeptidase family M24 containing protein 0.0167 0.1002 0.1002
Loa Loa (eye worm) hypothetical protein 0.0096 0.0553 0.0553
Mycobacterium ulcerans methionine aminopeptidase MapB 0.1318 0.838 1
Brugia malayi metabotropic glutamate receptor subtype 5a (mGluR5a), putative 0.0036 0.0164 0.0164
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0204 0.1241 0.1241
Loa Loa (eye worm) hypothetical protein 0.0048 0.0246 0.0246
Mycobacterium leprae PROBABLE METHIONINE AMINOPEPTIDASE MAPA (MAP) (PEPTIDASE M) (MetAP) 0.1318 0.838 1
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0794 0.5023 0.5005
Toxoplasma gondii methionine aminopeptidase 2, putative 0.0167 0.1002 0.089
Trypanosoma brucei methionine aminopeptidase, putative 0.1571 1 1
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0029 0.0123 0.0089
Echinococcus multilocularis protein dispatched 1 0.0047 0.0238 0.0204
Trypanosoma cruzi hypothetical protein, conserved 0.0253 0.1556 0.0615

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0 The compound was modelled in silico for carcinogenic potency; + = Carcinogen ChEMBL. 7108894

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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