Detailed information for compound 1564602

Basic information

Technical information
  • TDR Targets ID: 1564602
  • Name: N-(phenylmethyl)methanesulfonamide
  • MW: 185.243 | Formula: C8H11NO2S
  • H donors: 1 H acceptors: 2 LogP: 0.82 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: CS(=O)(=O)NCc1ccccc1
  • InChi: 1S/C8H11NO2S/c1-12(10,11)9-7-8-5-3-2-4-6-8/h2-6,9H,7H2,1H3
  • InChiKey: JPZKJABGOSPYDD-UHFFFAOYSA-N  

Network

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Synonyms

  • N-(benzyl)methanesulfonamide
  • 3989-45-5
  • ST5185555
  • ZINC03157602
  • Maybridge1_001741
  • NSC36910
  • ChemDiv2_000126

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 Zn-finger in Ran binding protein and others containing protein 0.0097 0.0573 0.1879
Trypanosoma cruzi hypothetical protein, conserved 0.0097 0.0573 1
Chlamydia trachomatis DNA topoisomerase I 0.0272 0.3052 0.5
Plasmodium vivax SWIB/MDM2 domain-containing protein, putative 0.0272 0.3052 0.5
Brugia malayi Zn-finger in Ran binding protein and others containing protein 0.0097 0.0573 0.1879
Schistosoma mansoni brg-1 associated factor 0.0272 0.3052 1
Trypanosoma cruzi hypothetical protein, conserved 0.0097 0.0573 1
Leishmania major hypothetical protein, conserved 0.0097 0.0573 1
Brugia malayi Zn-finger in Ran binding protein and others containing protein 0.0097 0.0573 0.1879
Trypanosoma cruzi Zn-finger in Ran binding protein and others, putative 0.0097 0.0573 1
Brugia malayi Zn-finger in Ran binding protein and others containing protein 0.0097 0.0573 0.1879
Schistosoma mansoni cellular tumor antigen P53 0.0112 0.0785 0.0853
Trypanosoma brucei hypothetical protein, conserved 0.0097 0.0573 1
Schistosoma mansoni hypothetical protein 0.0272 0.3052 1
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0056 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0097 0.0573 0.1879
Brugia malayi brahma associated protein 60 kDa 0.0272 0.3052 1
Trypanosoma cruzi hypothetical protein, conserved 0.0097 0.0573 1
Loa Loa (eye worm) hypothetical protein 0.0097 0.0573 0.1879
Loa Loa (eye worm) hypothetical protein 0.0097 0.0573 0.1879
Trypanosoma cruzi Zn-finger in Ran binding protein and others, putative 0.0097 0.0573 1
Leishmania major hypothetical protein, conserved 0.0097 0.0573 1
Loa Loa (eye worm) hypothetical protein 0.0112 0.0785 0.2572
Echinococcus granulosus SWI:SNF matrix associated 0.0272 0.3052 0.263
Trichomonas vaginalis conserved hypothetical protein 0.0272 0.3052 0.5
Plasmodium falciparum SWIB/MDM2 domain-containing protein 0.0272 0.3052 1
Trypanosoma cruzi Zn-finger in Ran binding protein and others/FYVE zinc finger, putative 0.0097 0.0573 1
Brugia malayi YY1-associated factor 2 0.0097 0.0573 0.1879
Loa Loa (eye worm) hypothetical protein 0.0097 0.0573 0.1879
Schistosoma mansoni hypothetical protein 0.0272 0.3052 1
Echinococcus granulosus Upstream activation factor subunit UAF30 0.0272 0.3052 0.263
Trypanosoma brucei mitochondrial RNA binding complex 1 subunit 0.0097 0.0573 1
Chlamydia trachomatis SWIB complex protein 0.0272 0.3052 0.5
Trypanosoma cruzi WLM domain containing protein, putative 0.0097 0.0573 1
Trypanosoma cruzi mitochondrial RNA binding complex 1 subunit, putative 0.0097 0.0573 1
Loa Loa (eye worm) brahma associated protein 0.0272 0.3052 1
Plasmodium vivax hypothetical protein, conserved 0.0272 0.3052 0.5
Trypanosoma brucei hypothetical protein, conserved 0.0097 0.0573 1
Onchocerca volvulus 0.0112 0.0785 0.0853
Toxoplasma gondii SWIB/MDM2 domain-containing protein 0.0272 0.3052 1
Trypanosoma cruzi mitochondrial RNA binding complex 1 subunit, putative 0.0097 0.0573 1
Trypanosoma cruzi WLM domain containing protein, putative 0.0097 0.0573 1
Brugia malayi brahma associated protein 60 kDa 0.0272 0.3052 1
Leishmania major hypothetical protein, conserved 0.0097 0.0573 1
Loa Loa (eye worm) SWIB/MDM2 domain-containing protein 0.0272 0.3052 1
Echinococcus multilocularis Upstream activation factor subunit UAF30 0.0272 0.3052 0.263
Leishmania major hypothetical protein, conserved 0.0097 0.0573 1
Trypanosoma brucei Zn-finger in Ran binding protein and others/FYVE zinc finger, putative 0.0097 0.0573 1
Onchocerca volvulus 0.0272 0.3052 1
Echinococcus multilocularis SWI:SNF matrix associated 0.0272 0.3052 0.263
Echinococcus multilocularis tumor protein p63 0.0763 1 1
Schistosoma mansoni hypothetical protein 0.0272 0.3052 1
Echinococcus multilocularis SWI:SNF matrix associated 0.0272 0.3052 0.263
Leishmania major hypothetical protein, conserved 0.0097 0.0573 1
Brugia malayi SWIB/MDM2 domain containing protein 0.0272 0.3052 1
Loa Loa (eye worm) hypothetical protein 0.0097 0.0573 0.1879
Plasmodium falciparum SWIB/MDM2 domain-containing protein 0.0272 0.3052 1
Toxoplasma gondii DNA topoisomerase domain-containing protein 0.0272 0.3052 1
Echinococcus multilocularis SWI:SNF matrix associated 0.0272 0.3052 0.263

Activities

Activity type Activity value Assay description Source Reference
MIC (functional) > 100 uM Antimycobacterial activity against Mycobacterium tuberculosis H37Rv by ten-fold serial dilution method ChEMBL. 22128803
MIC99 (functional) > 50 ug ml-1 Antimycobacterial activity against Mycobacterium tuberculosis H37Rv by ten-fold serial dilution method ChEMBL. 22128803

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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