Detailed information for compound 891146

Basic information

Technical information
  • TDR Targets ID: 891146
  • Name: ethyl 2-(4-phenylsulfonylpiperazin-1-yl)aceta te
  • MW: 312.385 | Formula: C14H20N2O4S
  • H donors: 0 H acceptors: 3 LogP: 1.17 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOC(=O)CN1CCN(CC1)S(=O)(=O)c1ccccc1
  • InChi: 1S/C14H20N2O4S/c1-2-20-14(17)12-15-8-10-16(11-9-15)21(18,19)13-6-4-3-5-7-13/h3-7H,2,8-12H2,1H3
  • InChiKey: AFCOFRSAZNSZDI-UHFFFAOYSA-N  

Network

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Synonyms

  • 2-(4-phenylsulfonyl-1-piperazinyl)acetic acid ethyl ester
  • 2-(4-phenylsulfonylpiperazin-1-yl)acetic acid ethyl ester
  • ethyl 2-(4-phenylsulfonylpiperazin-1-yl)ethanoate
  • IVK/0012487

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 0.0401 0.4909 0.4909
Echinococcus granulosus vesicular acetylcholine transporter 0.0471 0.5839 1
Echinococcus granulosus transient receptor potential gamma protein 0.0117 0.1143 0.1958
Schistosoma mansoni transient receptor potential channel 0.0117 0.1143 0.0698
Schistosoma mansoni transient receptor potential channel 0.018 0.1975 0.2344
Echinococcus multilocularis transient receptor potential gamma protein 0.0117 0.1143 0.1958
Echinococcus multilocularis short transient receptor potential channel 6 0.018 0.1975 0.3382
Loa Loa (eye worm) hypothetical protein 0.0785 1 1
Echinococcus granulosus short transient receptor potential channel 6 0.0091 0.0791 0.1355
Echinococcus multilocularis short transient receptor potential channel 6 0.0091 0.0791 0.1355
Loa Loa (eye worm) hypothetical protein 0.0086 0.073 0.073
Brugia malayi vesicular acetylcholine transporter unc-17 0.0471 0.5839 0.5839
Trypanosoma brucei C-8 sterol isomerase, putative 0.0785 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0117 0.1143 0.1143
Schistosoma mansoni transient receptor potential channel 4 0.0117 0.1143 0.0698
Echinococcus granulosus short transient receptor potential channel 6 0.018 0.1975 0.3382
Echinococcus granulosus transient receptor potential ion channel A 0.0113 0.1083 0.1854
Schistosoma mansoni vesicular acetylcholine transporter 0.0471 0.5839 1
Echinococcus multilocularis vesicular acetylcholine transporter 0.0471 0.5839 1
Echinococcus multilocularis transient receptor potential ion channel A 0.0113 0.1083 0.1854
Onchocerca volvulus Vesicular acetylcholine transporter homolog 0.0471 0.5839 0.5
Trypanosoma cruzi C-8 sterol isomerase, putative 0.0785 1 0.5
Leishmania major C-8 sterol isomerase-like protein 0.0785 1 0.5
Loa Loa (eye worm) vesicular acetylcholine transporter unc-17 0.0471 0.5839 0.5839

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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