Detailed information for compound 1842426

Basic information

Technical information
  • TDR Targets ID: 1842426
  • Name: 4-ethoxy-9-propyl-4-sulfanylidene-3,5-dioxa-4 $l^{5}-phosphabicyclo[4.4.0]deca-1(6),7,9-tri ene
  • MW: 272.3 | Formula: C12H17O3PS
  • H donors: 0 H acceptors: 0 LogP: 4.34 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCc1ccc2c(c1)COP(=S)(O2)OCC
  • InChi: 1S/C12H17O3PS/c1-3-5-10-6-7-12-11(8-10)9-14-16(17,15-12)13-4-2/h6-8H,3-5,9H2,1-2H3
  • InChiKey: QUVSVIQQWBLJAG-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 4-ethoxy-9-propyl-4-thioxo-3,5-dioxa-4$l^{5}-phosphabicyclo[4.4.0]deca-1(6),7,9-triene

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
Loa Loa (eye worm) hypothetical protein 0.0029 0.0026 0.0026
Echinococcus multilocularis lysine specific demethylase 5A 0.0036 0.0037 0.0014
Toxoplasma gondii bifunctional dihydrofolate reductase-thymidylate synthase 0.2141 0.3807 1
Brugia malayi Bromodomain containing protein 0.0029 0.0026 0.0026
Trypanosoma brucei dihydrofolate reductase-thymidylate synthase 0.2141 0.3807 1
Echinococcus multilocularis dihydrofolate reductase 0.5598 1 1
Brugia malayi jmjC domain containing protein 0.0036 0.0037 0.0037
Loa Loa (eye worm) hypothetical protein 0.0028 0.0023 0.0023
Plasmodium vivax hypothetical protein, conserved 0.0029 0.0026 0.0024
Onchocerca volvulus Alhambra homolog 0.0029 0.0026 0.0825
Echinococcus multilocularis PHD finger protein rhinoceros 0.0029 0.0026 0.0003
Brugia malayi PHD-finger family protein 0.0029 0.0026 0.0026
Plasmodium vivax bifunctional dihydrofolate reductase-thymidylate synthase, putative 0.2141 0.3807 1
Loa Loa (eye worm) hypothetical protein 0.0027 0.0022 0.0022
Toxoplasma gondii PHD-finger domain-containing protein 0.0029 0.0026 0.0024
Echinococcus multilocularis high affinity cAMP specific 3',5' cyclic 0.038 0.0654 0.0633
Brugia malayi jmjC domain containing protein 0.0096 0.0146 0.0146
Schistosoma mansoni dihydrofolate reductase 0.5598 1 1
Brugia malayi hypothetical protein 0.0024 0.0017 0.0017
Echinococcus granulosus tumor protein p63 0.034 0.0583 0.0562
Mycobacterium ulcerans dihydrofolate reductase DfrA 0.5598 1 0.5
Loa Loa (eye worm) dihydrofolate reductase 0.5598 1 1
Echinococcus granulosus dihydrofolate reductase 0.5598 1 1
Echinococcus multilocularis peregrin 0.0029 0.0026 0.0003
Schistosoma mansoni jumonji domain containing protein 0.0076 0.011 0.0088
Mycobacterium leprae DIHYDROFOLATE REDUCTASE DFRA (DHFR) (TETRAHYDROFOLATE DEHYDROGENASE) 0.5598 1 0.5
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0028 0.0023 0.0023
Loa Loa (eye worm) jmjC domain-containing protein 0.0036 0.0037 0.0037
Brugia malayi Dihydrofolate reductase 0.5598 1 1
Brugia malayi hypothetical protein 0.0016 0.0002 0.0002
Loa Loa (eye worm) hypothetical protein 0.005 0.0064 0.0064
Echinococcus granulosus jumonji domain containing protein 0.0041 0.0047 0.0024
Echinococcus granulosus peregrin 0.0029 0.0026 0.0003
Echinococcus granulosus PHD finger protein rhinoceros 0.0029 0.0026 0.0003
Schistosoma mansoni jumonji/arid domain-containing protein 0.0036 0.0037 0.0014
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0096 0.0146 0.0123
Loa Loa (eye worm) PHD-finger family protein 0.0029 0.0026 0.0026
Loa Loa (eye worm) hypothetical protein 0.0024 0.0017 0.0017
Mycobacterium tuberculosis Dihydrofolate reductase DfrA (DHFR) (tetrahydrofolate dehydrogenase) 0.5598 1 0.5
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0096 0.0146 0.0123
Echinococcus granulosus lysine specific demethylase 5A 0.0036 0.0037 0.0014
Schistosoma mansoni cellular tumor antigen P53 0.005 0.0063 0.004
Trypanosoma cruzi dihydrofolate reductase-thymidylate synthase 0.2141 0.3807 1
Chlamydia trachomatis dihydrofolate reductase 0.5598 1 0.5
Echinococcus multilocularis tumor protein p63 0.034 0.0583 0.0562
Brugia malayi Intermediate filament tail domain containing protein 0.0028 0.0023 0.0023
Schistosoma mansoni hypothetical protein 0.0029 0.0026 0.0003
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0029 0.0026 0.0003
Brugia malayi intermediate filament protein 0.0028 0.0023 0.0023
Loa Loa (eye worm) hypothetical protein 0.005 0.0063 0.0063
Plasmodium falciparum phd finger protein, putative 0.0029 0.0026 0.0024
Leishmania major dihydrofolate reductase-thymidylate synthase 0.2141 0.3807 1
Loa Loa (eye worm) jmjC domain-containing protein 0.0061 0.0082 0.0082
Giardia lamblia PHD finger protein 15 0.0029 0.0026 0.5
Plasmodium falciparum bifunctional dihydrofolate reductase-thymidylate synthase 0.2141 0.3807 1
Schistosoma mansoni jumonji/arid domain-containing protein 0.0036 0.0037 0.0014
Onchocerca volvulus 0.005 0.0063 1
Echinococcus multilocularis jumonji domain containing protein 0.0041 0.0047 0.0024
Loa Loa (eye worm) intermediate filament protein 0.0028 0.0023 0.0023
Echinococcus granulosus high affinity cAMP specific 3'5' cyclic 0.038 0.0654 0.0633
Toxoplasma gondii PHD-finger domain-containing protein 0.0029 0.0026 0.0024

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.