Detailed information for compound 2074234

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 358.521 | Formula: C21H34N4O
  • H donors: 2 H acceptors: 1 LogP: 4.65 Rotable bonds: 12
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCCCCCCc1ccc(cc1)CNC(=O)[C@@H]1CCCN1C(=N)N
  • InChi: 1S/C21H34N4O/c1-2-3-4-5-6-7-9-17-11-13-18(14-12-17)16-24-20(26)19-10-8-15-25(19)21(22)23/h11-14,19H,2-10,15-16H2,1H3,(H3,22,23)(H,24,26)/t19-/m0/s1
  • InChiKey: RJHFYCXQNHVPJY-IBGZPJMESA-N  

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
Leishmania major beta tubulin 0.0375 0.5 0.5
Leishmania major beta tubulin 0.0375 0.5 0.5
Loa Loa (eye worm) tubulin beta-2A chain 0.0375 0.5 0.5
Echinococcus multilocularis tubulin beta 1 chain 0.0375 0.5 0.5
Trypanosoma brucei beta tubulin 0.0375 0.5 0.5
Trichomonas vaginalis tubulin epsilon chain, putative 0.0375 0.5 0.5
Schistosoma mansoni tubulin subunit beta 0.0375 0.5 0.5
Echinococcus granulosus tubulin beta 4A class IVa 0.0375 0.5 0.5
Leishmania major beta tubulin 0.0375 0.5 0.5
Loa Loa (eye worm) tubulin beta-1 chain 0.0375 0.5 0.5
Echinococcus multilocularis tubulin, beta 4A class IVa 0.0375 0.5 0.5
Plasmodium vivax tubulin beta chain, putative 0.0375 0.5 0.5
Giardia lamblia Beta tubulin 0.0375 0.5 0.5
Loa Loa (eye worm) beta-tubulin 0.0375 0.5 0.5
Leishmania major beta tubulin 0.0375 0.5 0.5
Toxoplasma gondii beta-tubulin, putative 0.0375 0.5 0.5
Leishmania major beta tubulin 0.0375 0.5 0.5
Schistosoma mansoni tubulin subunit beta 0.0375 0.5 0.5
Leishmania major beta tubulin 0.0375 0.5 0.5
Leishmania major beta tubulin 0.0375 0.5 0.5
Brugia malayi beta-tubulin, identical 0.0375 0.5 0.5
Echinococcus multilocularis beta tubulin 0.0375 0.5 0.5
Toxoplasma gondii beta tubulin 0.0375 0.5 0.5
Leishmania major beta tubulin 0.0375 0.5 0.5
Leishmania major beta tubulin 0.0375 0.5 0.5
Trichomonas vaginalis tubulin gamma chain, putative 0.0375 0.5 0.5
Entamoeba histolytica tubulin family protein 0.0375 0.5 0.5
Loa Loa (eye worm) tubulin beta chain 0.0375 0.5 0.5
Echinococcus multilocularis Tubulin beta 2C chain 0.0375 0.5 0.5
Leishmania major beta tubulin 0.0375 0.5 0.5
Echinococcus granulosus beta tubulin 0.0375 0.5 0.5
Echinococcus granulosus Tubulin beta 2C chain 0.0375 0.5 0.5
Schistosoma mansoni tubulin subunit beta 0.0375 0.5 0.5
Echinococcus granulosus beta tubulin 0.0375 0.5 0.5
Leishmania major beta tubulin 0.0375 0.5 0.5
Leishmania major beta tubulin 0.0375 0.5 0.5
Trypanosoma cruzi beta tubulin, putative 0.0375 0.5 0.5
Entamoeba histolytica tubulin family protein 0.0375 0.5 0.5
Trichomonas vaginalis tubulin, putative 0.0375 0.5 0.5
Leishmania major beta tubulin 0.0375 0.5 0.5
Echinococcus granulosus Tubulin beta 2C chain 0.0375 0.5 0.5
Leishmania major beta tubulin 0.0375 0.5 0.5
Loa Loa (eye worm) BEN-1 protein 0.0375 0.5 0.5
Echinococcus granulosus tubulin subunit beta 0.0375 0.5 0.5
Trichomonas vaginalis tubulin alpha chain, putative 0.0375 0.5 0.5
Trichomonas vaginalis tubulin beta chain, putative 0.0375 0.5 0.5
Echinococcus multilocularis Tubulin beta 2C chain 0.0375 0.5 0.5
Echinococcus multilocularis Tubulin beta 2C chain 0.0375 0.5 0.5
Trypanosoma brucei beta tubulin 0.0375 0.5 0.5
Schistosoma mansoni tubulin subunit beta 0.0375 0.5 0.5
Schistosoma mansoni tubulin subunit beta 0.0375 0.5 0.5
Leishmania major beta tubulin 0.0375 0.5 0.5
Loa Loa (eye worm) BEN-1 protein 0.0375 0.5 0.5
Toxoplasma gondii beta-1 tubulin, putative 0.0375 0.5 0.5
Leishmania major beta tubulin 0.0375 0.5 0.5
Echinococcus granulosus Tubulin beta 2C chain 0.0375 0.5 0.5
Echinococcus granulosus Tubulin beta 2C chain 0.0375 0.5 0.5
Loa Loa (eye worm) tubulin beta-4 chain 0.0375 0.5 0.5
Echinococcus multilocularis beta tubulin 0.0375 0.5 0.5
Echinococcus multilocularis Tubulin beta 2C chain 0.0375 0.5 0.5
Leishmania major beta tubulin 0.0375 0.5 0.5
Giardia lamblia Beta tubulin 0.0375 0.5 0.5
Echinococcus multilocularis Tubulin beta 2C chain 0.0375 0.5 0.5
Echinococcus granulosus Tubulin beta 2C chain 0.0375 0.5 0.5
Echinococcus multilocularis tubulin subunit beta 0.0375 0.5 0.5
Schistosoma mansoni tubulin subunit beta 0.0375 0.5 0.5
Trichomonas vaginalis tubulin epsilon chain, putative 0.0375 0.5 0.5
Echinococcus granulosus tubulin beta 1 chain 0.0375 0.5 0.5
Giardia lamblia Beta tubulin 0.0375 0.5 0.5
Leishmania major beta tubulin 0.0375 0.5 0.5
Plasmodium falciparum tubulin beta chain 0.0375 0.5 0.5
Trypanosoma brucei beta tubulin 0.0375 0.5 0.5
Trypanosoma brucei beta tubulin 0.0375 0.5 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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