Detailed information for compound 1773511

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 290.293 | Formula: C14H15FN4O2
  • H donors: 2 H acceptors: 2 LogP: 1.43 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: COC1CNC(=O)c2c(N1)n(cn2)Cc1ccc(cc1)F
  • InChi: 1S/C14H15FN4O2/c1-21-11-6-16-14(20)12-13(18-11)19(8-17-12)7-9-2-4-10(15)5-3-9/h2-5,8,11,18H,6-7H2,1H3,(H,16,20)
  • InChiKey: ZMIXCECILFUWSH-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

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
Plasmodium vivax hypothetical protein, conserved 0.004 0.0952 0.5
Trypanosoma cruzi UDP-galactopyranose mutase 0.004 0.0952 0.5
Brugia malayi SWIRM domain containing protein 0.011 0.2934 0.5594
Plasmodium falciparum lysine-specific histone demethylase 1, putative 0.004 0.0952 0.5
Loa Loa (eye worm) hypothetical protein 0.0192 0.5245 0.9706
Chlamydia trachomatis protoporphyrinogen oxidase 0.004 0.0952 0.5
Echinococcus multilocularis protoporphyrinogen oxidase 0.004 0.0952 0.347
Echinococcus multilocularis lysine specific histone demethylase 1A 0.0104 0.2744 1
Loa Loa (eye worm) hypothetical protein 0.0104 0.2744 0.5078
Loa Loa (eye worm) hypothetical protein 0.0197 0.5404 1
Brugia malayi hypothetical protein 0.004 0.0952 0.1815
Brugia malayi amine oxidase, flavin-containing family protein 0.0047 0.1142 0.2178
Loa Loa (eye worm) hypothetical protein 0.004 0.0952 0.1762
Loa Loa (eye worm) hypothetical protein 0.011 0.2934 0.543
Plasmodium vivax protoporphyrinogen oxidase, putative 0.004 0.0952 0.5
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.004 0.0952 0.5
Echinococcus granulosus lysine specific histone demethylase 1A 0.0104 0.2744 1
Loa Loa (eye worm) hypothetical protein 0.004 0.0952 0.1762
Mycobacterium leprae PROBABLE PROTOPORPHYRINOGEN OXIDASE HEMY (PROTOPORPHYRINOGEN-IX OXIDASE) (PROTOPORPHYRINOGENASE) (PPO) 0.004 0.0952 0.5
Echinococcus multilocularis 0.004 0.0952 0.347
Schistosoma mansoni Lysine-specific histone demethylase 1 0.0104 0.2744 1
Brugia malayi Myb-like DNA-binding domain containing protein 0.0192 0.5245 1
Schistosoma mansoni amine oxidase 0.004 0.0952 0.347
Toxoplasma gondii histone lysine-specific demethylase LSD1/BHC110/KDMA1A 0.004 0.0952 1
Schistosoma mansoni amine oxidase 0.004 0.0952 0.347
Toxoplasma gondii histone lysine-specific demethylase 0.004 0.0952 1
Loa Loa (eye worm) hypothetical protein 0.0104 0.2744 0.5078
Plasmodium falciparum protoporphyrinogen oxidase 0.004 0.0952 0.5
Echinococcus granulosus lysine specific histone demethylase 1A 0.004 0.0952 0.347
Mycobacterium ulcerans flavin-containing monoamine oxidase AofH 0.036 1 1
Onchocerca volvulus CoRest homolog 0.0197 0.5404 1
Schistosoma mansoni Protoporphyrinogen oxidase chloroplast/mitochondrial precursor 0.004 0.0952 0.347
Loa Loa (eye worm) hypothetical protein 0.0047 0.1142 0.2114
Leishmania major UDP-galactopyranose mutase 0.004 0.0952 0.5
Plasmodium vivax lysine-specific histone demethylase 1, putative 0.004 0.0952 0.5
Trypanosoma cruzi UDP-galactopyranose mutase 0.004 0.0952 0.5
Mycobacterium tuberculosis Probable flavin-containing monoamine oxidase AofH (amine oxidase) (MAO) 0.0319 0.8858 1
Plasmodium vivax hypothetical protein, conserved 0.004 0.0952 0.5

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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