Detailed information for compound 881061

Basic information

Technical information
  • TDR Targets ID: 881061
  • Name: 1-[2-(1-cyclohexenyl)ethyl]-3-(4-diethylamino phenyl)thiourea
  • MW: 331.519 | Formula: C19H29N3S
  • H donors: 2 H acceptors: 0 LogP: 4.43 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCN(c1ccc(cc1)NC(=S)NCCC1=CCCCC1)CC
  • InChi: 1S/C19H29N3S/c1-3-22(4-2)18-12-10-17(11-13-18)21-19(23)20-15-14-16-8-6-5-7-9-16/h8,10-13H,3-7,9,14-15H2,1-2H3,(H2,20,21,23)
  • InChiKey: IYEHXGSRRDYUKD-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • Oprea1_217345

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
Brugia malayi Protein kinase domain containing protein 0.1464 0.5084 0.509
Echinococcus multilocularis insulin receptor 0.2646 0.9987 0.9987
Schistosoma mansoni tyrosine kinase 0.2646 0.9987 1
Echinococcus granulosus insulin receptor 0.2646 0.9987 0.9979
Mycobacterium tuberculosis Probable polypeptide deformylase Def (PDF) (formylmethionine deformylase) 0.1452 0.5037 0.5
Plasmodium falciparum peptide deformylase 0.1452 0.5037 0.5
Toxoplasma gondii hypothetical protein 0.1452 0.5037 0.5
Mycobacterium leprae PROBABLE POLYPEPTIDE DEFORMYLASE DEF (PDF) (FORMYLMETHIONINE DEFORMYLASE) 0.1452 0.5037 0.5
Trypanosoma cruzi polypeptide deformylase-like protein, putative 0.0554 0.1312 1
Schistosoma mansoni tyrosine kinase 0.2646 0.9987 1
Treponema pallidum polypeptide deformylase (def) 0.1452 0.5037 0.5
Schistosoma mansoni tyrosine kinase 0.1204 0.4005 0.0146
Echinococcus multilocularis epidermal growth factor receptor 0.1204 0.4005 0.3725
Trypanosoma cruzi Peptide deformylase 2, putative 0.0554 0.1312 1
Echinococcus multilocularis insulin growth factor 1 receptor beta 0.2649 1 1
Loa Loa (eye worm) TK/INSR protein kinase 0.2646 0.9987 1
Brugia malayi Furin-like cysteine rich region family protein 0.1204 0.4005 0.401
Schistosoma mansoni tyrosine kinase 0.1204 0.4005 0.0146
Trypanosoma brucei Polypeptide deformylase 1 0.0554 0.1312 1
Echinococcus multilocularis epidermal growth factor receptor 0.1204 0.4005 0.3725
Schistosoma mansoni tyrosine kinase 0.1204 0.4005 0.0146
Trypanosoma cruzi polypeptide deformylase-like protein, putative 0.0554 0.1312 1
Chlamydia trachomatis peptide deformylase 0.1452 0.5037 0.5
Leishmania major polypeptide deformylase-like protein, putative 0.0554 0.1312 1
Loa Loa (eye worm) hypothetical protein 0.1442 0.4995 0.5002
Trypanosoma cruzi Peptide deformylase 2, putative 0.0554 0.1312 1
Wolbachia endosymbiont of Brugia malayi peptide deformylase 0.1452 0.5037 0.5
Loa Loa (eye worm) TK/EGFR protein kinase 0.1204 0.4005 0.401
Brugia malayi Protein kinase domain containing protein 0.2646 0.9987 1
Plasmodium vivax peptide deformylase, putative 0.1452 0.5037 0.5
Trypanosoma brucei Peptide deformylase 2 0.0554 0.1312 1
Mycobacterium ulcerans peptide deformylase 0.1452 0.5037 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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