Detailed information for compound 1186060

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 236.33 | Formula: C13H16O2S
  • H donors: 1 H acceptors: 2 LogP: 2.82 Rotable bonds: 1
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C1C=C([C@@](S1)(C)/C=C/1\CCCCC=C1)O
  • InChi: 1S/C13H16O2S/c1-13(11(14)8-12(15)16-13)9-10-6-4-2-3-5-7-10/h4,6,8-9,14H,2-3,5,7H2,1H3/b10-9-/t13-/m1/s1
  • InChiKey: OYPGKGVZFWZXLZ-ASCRHOAZSA-N  

Network

Hover on a compound node to display the structore

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
Entamoeba histolytica recQ family helicase, putative 0.0021 0.3705 0.3705
Entamoeba histolytica recQ family DNA helicase 0.0011 0.0141 0.0141
Loa Loa (eye worm) hypothetical protein 0.0021 0.3705 0.3615
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative 0.0011 0.0141 1
Treponema pallidum ATP-dependent DNA helicase 0.0011 0.0141 0.5
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0021 0.3705 1
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0011 0.0141 0.0381
Schistosoma mansoni DNA helicase recq1 0.0021 0.3705 0.3705
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0021 0.3705 0.3615
Schistosoma mansoni blooms syndrome DNA helicase 0.0011 0.0141 0.0141
Loa Loa (eye worm) hypothetical protein 0.0011 0.0141 0.0000000030405
Plasmodium falciparum ATP-dependent DNA helicase Q1 0.0021 0.3705 0.5
Schistosoma mansoni DNA helicase recq5 0.0021 0.3705 0.3705
Loa Loa (eye worm) ATP-dependent DNA helicase 0.0021 0.3705 0.3615
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0021 0.3705 0.5
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0021 0.3705 1
Loa Loa (eye worm) RecQ helicase 0.0021 0.3705 0.3615

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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.