Detailed information for compound 1804761

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 299.369 | Formula: C14H22NO2PS
  • H donors: 1 H acceptors: 0 LogP: 5.02 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCc1ccc2c(c1)COP(=S)(O2)NCC(C)C
  • InChi: 1S/C14H22NO2PS/c1-4-5-12-6-7-14-13(8-12)10-16-18(19,17-14)15-9-11(2)3/h6-8,11H,4-5,9-10H2,1-3H3,(H,15,19)
  • InChiKey: UEQJFVOMBKNEHP-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 falciparum SWIB/MDM2 domain-containing protein 0.0076 0.0918 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.0062 0.0648 0.5
Trypanosoma brucei hypothetical protein, conserved 0.0027 0 0.5
Plasmodium falciparum SWIB/MDM2 domain-containing protein 0.0076 0.0918 1
Schistosoma mansoni hypothetical protein 0.0076 0.0918 0.0918
Echinococcus multilocularis SWI:SNF matrix associated 0.0076 0.0918 0.0918
Loa Loa (eye worm) hypothetical protein 0.0153 0.2334 0.2334
Brugia malayi SWIB/MDM2 domain containing protein 0.0076 0.0918 0.0918
Trypanosoma cruzi hypothetical protein, conserved 0.0027 0 0.5
Onchocerca volvulus 0.0564 1 1
Schistosoma mansoni hypothetical protein 0.0076 0.0918 0.0918
Trypanosoma cruzi WLM domain containing protein, putative 0.0027 0 0.5
Trypanosoma brucei Zn-finger in Ran binding protein and others/FYVE zinc finger, putative 0.0027 0 0.5
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0062 0.0648 0.0648
Trypanosoma cruzi hypothetical protein, conserved 0.0027 0 0.5
Trypanosoma cruzi Zn-finger in Ran binding protein and others/FYVE zinc finger, putative 0.0027 0 0.5
Trypanosoma cruzi mitochondrial RNA binding complex 1 subunit, putative 0.0027 0 0.5
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0062 0.0648 0.5
Echinococcus granulosus SWI:SNF matrix associated 0.0076 0.0918 0.0918
Echinococcus multilocularis SWI:SNF matrix associated 0.0076 0.0918 0.0918
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0051 0.0442 0.0442
Echinococcus granulosus muscleblind protein 0.0153 0.2334 0.2334
Schistosoma mansoni aldehyde dehydrogenase 0.0062 0.0648 0.0648
Echinococcus granulosus protein will die slowly 0.0564 1 1
Trypanosoma brucei mitochondrial RNA binding complex 1 subunit 0.0027 0 0.5
Loa Loa (eye worm) brahma associated protein 0.0076 0.0918 0.0918
Chlamydia trachomatis DNA topoisomerase I 0.0076 0.0918 0.5
Plasmodium vivax SWIB/MDM2 domain-containing protein, putative 0.0076 0.0918 0.5
Toxoplasma gondii aldehyde dehydrogenase 0.0062 0.0648 0.7064
Mycobacterium ulcerans aldehyde dehydrogenase 0.0062 0.0648 0.5
Loa Loa (eye worm) hypothetical protein 0.0035 0.0142 0.0142
Trypanosoma cruzi Zn-finger in Ran binding protein and others, putative 0.0027 0 0.5
Mycobacterium ulcerans aldehyde dehydrogenase 0.0062 0.0648 0.5
Chlamydia trachomatis SWIB complex protein 0.0076 0.0918 0.5
Loa Loa (eye worm) hypothetical protein 0.0051 0.0442 0.0442
Loa Loa (eye worm) hypothetical protein 0.0153 0.2334 0.2334
Toxoplasma gondii SWIB/MDM2 domain-containing protein 0.0076 0.0918 1
Onchocerca volvulus 0.0076 0.0918 0.0918
Echinococcus multilocularis SWI:SNF matrix associated 0.0076 0.0918 0.0918
Brugia malayi Muscleblind-like protein 0.0153 0.2334 0.2334
Schistosoma mansoni hypothetical protein 0.0076 0.0918 0.0918
Schistosoma mansoni hypothetical protein 0.0035 0.0142 0.0142
Brugia malayi latrophilin 2 splice variant baaae 0.0035 0.0142 0.0142
Brugia malayi brahma associated protein 60 kDa 0.0076 0.0918 0.0918
Trypanosoma cruzi WLM domain containing protein, putative 0.0027 0 0.5
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0051 0.0442 0.0442
Trypanosoma cruzi mitochondrial RNA binding complex 1 subunit, putative 0.0027 0 0.5
Loa Loa (eye worm) WD40 repeat protein 0.0564 1 1
Trypanosoma brucei hypothetical protein, conserved 0.0027 0 0.5
Echinococcus multilocularis muscleblind protein 1 0.0153 0.2334 0.2334
Trichomonas vaginalis WD repeat domain, putative 0.0564 1 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.0051 0.0442 0.0442
Echinococcus multilocularis muscleblind protein 0.0153 0.2334 0.2334
Schistosoma mansoni brg-1 associated factor 0.0076 0.0918 0.0918
Toxoplasma gondii DNA topoisomerase domain-containing protein 0.0076 0.0918 1
Plasmodium vivax hypothetical protein, conserved 0.0076 0.0918 0.5
Brugia malayi brahma associated protein 60 kDa 0.0076 0.0918 0.0918
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0062 0.0648 0.0648
Schistosoma mansoni hypothetical protein 0.0564 1 1
Trypanosoma cruzi hypothetical protein, conserved 0.0027 0 0.5
Schistosoma mansoni aldehyde dehydrogenase 0.0062 0.0648 0.0648
Loa Loa (eye worm) SWIB/MDM2 domain-containing protein 0.0076 0.0918 0.0918
Trypanosoma cruzi Zn-finger in Ran binding protein and others, putative 0.0027 0 0.5
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0062 0.0648 1
Echinococcus multilocularis protein will die slowly 0.0564 1 1
Echinococcus multilocularis Upstream activation factor subunit UAF30 0.0076 0.0918 0.0918
Echinococcus granulosus Upstream activation factor subunit UAF30 0.0076 0.0918 0.0918

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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