Detailed information for compound 870253

Basic information

Technical information
  • TDR Targets ID: 870253
  • Name: 1-ethyl-6-fluoro-4-methylquinolin-1-ium
  • MW: 190.237 | Formula: C12H13FN+
  • H donors: 0 H acceptors: 0 LogP: 3.09 Rotable bonds: 1
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC[n+]1ccc(c2c1ccc(c2)F)C
  • InChi: 1S/C12H13FN/c1-3-14-7-6-9(2)11-8-10(13)4-5-12(11)14/h4-8H,3H2,1-2H3/q+1
  • InChiKey: BMYINICQZZELQT-UHFFFAOYSA-N  

Network

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Synonyms

  • 1-ethyl-6-fluoro-4-methyl-quinolin-1-ium

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
Mycobacterium tuberculosis Probable NADH dehydrogenase I (chain F) NuoF (NADH-ubiquinone oxidoreductase chain F) 0.0242 0.1104 0.0663
Schistosoma mansoni aryl hydrocarbon receptor 0.0097 0.0163 0.0496
Echinococcus multilocularis CAAX prenyl protease 2 0.0089 0.0114 0.1034
Echinococcus multilocularis NADH dehydrogenase (ubiquinone) flavoprotein 1 0.0242 0.1104 1
Entamoeba histolytica CAAX prenyl protease family 0.0089 0.0114 0.5
Schistosoma mansoni single-minded 0.0097 0.0163 0.0496
Mycobacterium tuberculosis Proteasome alpha subunit PrcA; assembles with beta subunit PrcB. 0.1612 1 1
Echinococcus granulosus NADH dehydrogenase ubiquinone flavoprotein 1 0.0242 0.1104 1
Echinococcus granulosus NADH dehydrogenase subunit 1 0.0144 0.0472 0.4277
Mycobacterium ulcerans NADH dehydrogenase I subunit F 0.0242 0.1104 0.1104
Schistosoma mansoni NADH-ubiquinone oxidoreductase 0.0242 0.1104 1
Mycobacterium ulcerans NADH dehydrogenase subunit H 0.0144 0.0472 0.0472
Leishmania major NADH-ubiquinone oxidoreductase, mitochondrial, putative 0.0242 0.1104 1
Onchocerca volvulus NADH dehydrogenase [ubiquinone] flavoprotein 1, mitochondrial homolog 0.013 0.0376 1
Giardia lamblia Hypothetical protein 0.0089 0.0114 0.5
Wolbachia endosymbiont of Brugia malayi NADH dehydrogenase I subunit F 0.0242 0.1104 1
Brugia malayi hypoxia-induced factor 1 0.0299 0.1479 0.9006
Brugia malayi PAS domain containing protein 0.0097 0.0163 0.0994
Trypanosoma brucei NADH dehydrogenase [ubiquinone] flavoprotein 1, mitochondrial, putative 0.0242 0.1104 1
Brugia malayi NADH-ubiquinone oxidoreductase 51 kDa subunit, mitochondrial precursor 0.0242 0.1104 0.6721
Trypanosoma cruzi NADH-ubiquinone oxidoreductase, mitochondrial, putative 0.0242 0.1104 1
Trichomonas vaginalis NADH-ubiquinone oxidoreductase flavoprotein, putative 0.0242 0.1104 1
Echinococcus granulosus CAAX prenyl protease 2 0.0089 0.0114 0.1034
Trypanosoma brucei NADH dehydrogenase [ubiquinone] flavoprotein 1, mitochondrial 0.0242 0.1104 1
Trichomonas vaginalis NADH-ubiquinone oxidoreductase flavoprotein, putative 0.0242 0.1104 1
Brugia malayi CAAX amino terminal protease family protein 0.0089 0.0114 0.0695
Schistosoma mansoni hypothetical protein 0.0144 0.0472 0.3616
Brugia malayi hypothetical protein 0.0325 0.1642 1
Loa Loa (eye worm) hypothetical protein 0.0325 0.1642 1
Trypanosoma cruzi NADH-ubiquinone oxidoreductase, mitochondrial, putative 0.0242 0.1104 1
Loa Loa (eye worm) hypoxia-induced factor 1 0.0299 0.1479 0.8932
Loa Loa (eye worm) NADH-ubiquinone oxidoreductase 51 kDa subunit 0.0242 0.1104 0.6476
Mycobacterium ulcerans proteasome PrcA 0.1612 1 1

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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