Detailed information for compound 1611111

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 324.42 | Formula: C19H24N4O
  • H donors: 1 H acceptors: 2 LogP: 1.01 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C1NCc2c(CC31CCN(CC3)Cc1nccn1C)cccc2
  • InChi: 1S/C19H24N4O/c1-22-11-8-20-17(22)14-23-9-6-19(7-10-23)12-15-4-2-3-5-16(15)13-21-18(19)24/h2-5,8,11H,6-7,9-10,12-14H2,1H3,(H,21,24)
  • InChiKey: FYMJCCGKQCNMIP-UHFFFAOYSA-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
Trichomonas vaginalis conserved hypothetical protein 0.0197 0.1634 0.5727
Onchocerca volvulus 0.0256 0.2853 0.5
Echinococcus multilocularis cAMP and cAMP inhibited cGMP 3',5' cyclic 0.0601 1 1
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0197 0.1634 0.5727
Toxoplasma gondii SWIB/MDM2 domain-containing protein 0.0256 0.2853 0.5
Loa Loa (eye worm) hypothetical protein 0.0491 0.7736 0.7493
Schistosoma mansoni cgmp-dependent 35-cyclic phosphodiesterase 0.0309 0.3945 1
Plasmodium vivax hypothetical protein, conserved 0.0256 0.2853 0.5
Echinococcus granulosus tumor protein p63 0.0326 0.4311 0.204
Echinococcus granulosus cAMP and cAMP inhibited cGMP 3'5' cyclic 0.0601 1 1
Plasmodium vivax SWIB/MDM2 domain-containing protein, putative 0.0256 0.2853 0.5
Toxoplasma gondii DNA topoisomerase domain-containing protein 0.0256 0.2853 0.5
Loa Loa (eye worm) hypothetical protein 0.0309 0.3945 0.1675
Chlamydia trachomatis SWIB complex protein 0.0256 0.2853 0.5
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0197 0.1634 0.5727
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0197 0.1634 0.5727
Brugia malayi 3'5'-cyclic nucleotide phosphodiesterase family protein 0.0309 0.3945 0.1527
Trichomonas vaginalis conserved hypothetical protein 0.0256 0.2853 1
Mycobacterium ulcerans two component sensor histidine kinase DevS 0.0167 0.1003 0.5
Chlamydia trachomatis DNA topoisomerase I 0.0256 0.2853 0.5
Plasmodium falciparum SWIB/MDM2 domain-containing protein 0.0256 0.2853 0.5
Mycobacterium tuberculosis Two component sensor histidine kinase DevS 0.0167 0.1003 0.5
Echinococcus multilocularis tumor protein p63 0.0326 0.4311 0.204
Loa Loa (eye worm) hypothetical protein 0.057 0.937 1
Plasmodium falciparum SWIB/MDM2 domain-containing protein 0.0256 0.2853 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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