Detailed information for compound 563954

Basic information

Technical information
  • TDR Targets ID: 563954
  • Name: 1-(1-oxidopyridin-1-ium-3-yl)ethanol
  • MW: 139.152 | Formula: C7H9NO2
  • H donors: 1 H acceptors: 2 LogP: -0.63 Rotable bonds: 1
    Rule of 5 violations (Lipinski): 1
  • SMILES: [O-][n+]1cccc(c1)C(O)C
  • InChi: 1S/C7H9NO2/c1-6(9)7-3-2-4-8(10)5-7/h2-6,9H,1H3
  • InChiKey: BKEWBKVKOXHXOQ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 1-(1-oxido-3-pyridin-1-iumyl)ethanol
  • 1-(1-oxidanidylpyridin-1-ium-3-yl)ethanol
  • 1-(3-pyridyl-N-oxide)ethanol

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
Trichomonas vaginalis hypothetical protein 0.0062 0.0636 0.1169
Loa Loa (eye worm) endoprotease bli-4 0.0323 1 1
Loa Loa (eye worm) hypothetical protein 0.0127 0.2944 0.2944
Trichomonas vaginalis neuroendocrine convertase 2 precursor, putative 0.0062 0.0636 0.1169
Trypanosoma cruzi Protein prenyltransferase alpha subunit repeat, putative 0.0045 0 0.5
Schistosoma mansoni subfamily S8B unassigned peptidase (S08 family) 0.0323 1 1
Echinococcus multilocularis 0.026 0.7754 1
Loa Loa (eye worm) hypothetical protein 0.0173 0.4597 0.4597
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.009 0.1633 0.1633
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0076 0.1133 0.208
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0196 0.5447 1
Loa Loa (eye worm) proprotein convertase 2 0.0076 0.1133 0.1133
Trichomonas vaginalis protein farnesyltransferase alpha subunit/RAB geranylgeranyl transferase alpha subunit, putative 0.0128 0.2988 0.5487
Echinococcus multilocularis neuroendocrine convertase 2 0.0203 0.5686 0.7333
Trypanosoma brucei protein farnesyltransferase alpha subunit, putative 0.0045 0 0.5
Trypanosoma brucei hypothetical protein, conserved 0.0045 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0323 1 1
Trichomonas vaginalis proprotein convertase subtilisin/kexin type, putative 0.0062 0.0636 0.1169
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0076 0.1133 0.208
Trypanosoma brucei Protein prenyltransferase alpha subunit repeat, putative 0.0045 0 0.5
Echinococcus granulosus Furin 1 0.0076 0.1133 0.1133
Echinococcus multilocularis proprotein convertase subtilisin:kexin type 5 0.0196 0.5447 0.7024
Onchocerca volvulus 0.0045 0 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0062 0.0636 0.1169
Schistosoma mansoni protein farnesyltransferase alpha subunit 0.0173 0.4597 0.4597
Trypanosoma brucei Protein prenyltransferase alpha subunit repeat, putative 0.0045 0 0.5
Brugia malayi proprotein convertase 2 0.0203 0.5686 0.5686
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.009 0.1633 0.1633
Trypanosoma cruzi hypothetical protein, conserved 0.0045 0 0.5
Schistosoma mansoni furin-1 (S08 family) 0.014 0.3441 0.3441
Echinococcus multilocularis protein farnesyltransferase alpha subunit 0.0173 0.4597 0.5929
Trichomonas vaginalis protein farnesyltransferase alpha subunit, putative 0.0173 0.4597 0.8441
Giardia lamblia Rab geranylgeranyltransferase 0.0173 0.4597 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.009 0.1633 0.1633
Trichomonas vaginalis conserved hypothetical protein 0.0062 0.0636 0.1169
Echinococcus granulosus protein farnesyltransferase alpha subunit 0.0173 0.4597 0.4597
Trichomonas vaginalis protein farnesyltransferase alpha subunit/RAB geranylgeranyl transferase alpha subunit, putative 0.0173 0.4597 0.8441
Trichomonas vaginalis conserved hypothetical protein 0.0062 0.0636 0.1169
Echinococcus multilocularis Furin 1 0.0076 0.1133 0.1461
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0076 0.1133 0.208
Trichomonas vaginalis conserved hypothetical protein 0.0062 0.0636 0.1169
Trypanosoma cruzi protein farnesyltransferase alpha subunit, putative 0.0045 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0146 0.3638 0.3638
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.009 0.1633 0.1633
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.009 0.1633 0.1633
Brugia malayi neuroendocrine convertase 1 precursor 0.0203 0.5686 0.5686
Trypanosoma cruzi protein farnesyltransferase alpha subunit, putative 0.0045 0 0.5
Loa Loa (eye worm) prenyltransferase alpha subunit repeat containing protein 0.0173 0.4597 0.4597
Brugia malayi celfurPC protein 0.026 0.7754 0.7754
Trypanosoma cruzi hypothetical protein, conserved 0.0045 0 0.5
Echinococcus multilocularis muscleblind protein 0.0146 0.3638 0.4692
Loa Loa (eye worm) hypothetical protein 0.0146 0.3638 0.3638
Echinococcus granulosus furin 0.0323 1 1
Schistosoma mansoni hypothetical protein 0.0062 0.0636 0.0636
Trichomonas vaginalis protein farnesyltransferase alpha subunit, putative 0.0173 0.4597 0.8441
Echinococcus granulosus proprotein convertase subtilisin:kexin type 5 0.0196 0.5447 0.5447
Trichomonas vaginalis conserved hypothetical protein 0.0062 0.0636 0.1169
Trichomonas vaginalis conserved hypothetical protein 0.0062 0.0636 0.1169
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0076 0.1133 0.208
Toxoplasma gondii hypothetical protein 0.0128 0.2988 1
Trichomonas vaginalis conserved hypothetical protein 0.0062 0.0636 0.1169
Brugia malayi Protein prenyltransferase alpha subunit repeat containing protein 0.0173 0.4597 0.4597
Trichomonas vaginalis conserved hypothetical protein 0.0062 0.0636 0.1169
Plasmodium vivax prenyltransferase alpha subunit, putative 0.0173 0.4597 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.009 0.1633 0.2106
Trichomonas vaginalis leucine-rich repeat protein, BspA family 0.0062 0.0636 0.1169
Trichomonas vaginalis conserved hypothetical protein 0.0062 0.0636 0.1169
Trichomonas vaginalis conserved hypothetical protein 0.0062 0.0636 0.1169
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0076 0.1133 0.208
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.009 0.1633 0.1633
Leishmania major protein farnesyltransferase alpha subunit, putative 0.0045 0 0.5
Brugia malayi Muscleblind-like protein 0.0146 0.3638 0.3638
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0196 0.5447 1
Plasmodium falciparum protein farnesyltransferase subunit alpha 0.0173 0.4597 1
Echinococcus granulosus neuroendocrine convertase 2 0.0203 0.5686 0.5686
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0076 0.1133 0.208
Schistosoma mansoni subfamily S8B non-peptidase homologue (S08 family) 0.0076 0.1133 0.1133
Echinococcus granulosus muscleblind protein 0.0146 0.3638 0.3638
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.009 0.1633 0.1633
Echinococcus multilocularis muscleblind protein 1 0.0146 0.3638 0.4692
Entamoeba histolytica protein farnesyltransferase alpha subunit, putative 0.0173 0.4597 1
Giardia lamblia Furin precursor putative serine protease 0.0062 0.0636 0.1384
Giardia lamblia High cysteine membrane protein Group 2 0.012 0.2705 0.5883
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.009 0.1633 0.2106
Trichomonas vaginalis conserved hypothetical protein 0.0062 0.0636 0.1169

Activities

No activities found for this compound.

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

No literature references available for this target.

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