Detailed information for compound 723043

Basic information

Technical information
  • TDR Targets ID: 723043
  • Name: N-(3,4-difluorophenyl)-N-(2-morpholin-4-yl-2- oxoethyl)methanesulfonamide
  • MW: 334.339 | Formula: C13H16F2N2O4S
  • H donors: 0 H acceptors: 3 LogP: 0.43 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(N1CCOCC1)CN(S(=O)(=O)C)c1ccc(c(c1)F)F
  • InChi: 1S/C13H16F2N2O4S/c1-22(19,20)17(10-2-3-11(14)12(15)8-10)9-13(18)16-4-6-21-7-5-16/h2-3,8H,4-7,9H2,1H3
  • InChiKey: MTSMGXZVGPNSQO-UHFFFAOYSA-N  

Network

Hover on a compound node to display the structore

Synonyms

  • N-(3,4-difluorophenyl)-N-(2-morpholino-2-oxo-ethyl)methanesulfonamide
  • N-(3,4-difluorophenyl)-N-(2-morpholino-2-oxoethyl)methanesulfonamide
  • N-(3,4-difluorophenyl)-N-(2-keto-2-morpholino-ethyl)methanesulfonamide
  • N-(3,4-difluorophenyl)-N-(2-morpholin-4-yl-2-oxo-ethyl)methanesulfonamide
  • ZINC06730522

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
Trypanosoma brucei oxidoreductase-like protein 0.0058 0.0109 1
Brugia malayi Apoptosis regulator proteins, Bcl-2 family protein 0.0055 0.0062 0.0158
Leishmania major pteridine reductase 1 0.0058 0.0109 1
Schistosoma mansoni hypothetical protein 0.0055 0.0062 0.0158
Toxoplasma gondii 2,4-dienoyl CoA reductase 2, peroxisomal family protein 0.0058 0.0109 0.0109
Mycobacterium ulcerans enoyl-(acyl carrier protein) reductase 0.0748 1 1
Echinococcus granulosus dual specificity protein phosphatase 0.0323 0.3906 0.4271
Echinococcus multilocularis dual specificity protein phosphatase 0.0323 0.3906 0.4271
Toxoplasma gondii enoyl-acyl carrier reductase ENR 0.0748 1 1
Loa Loa (eye worm) hypothetical protein 0.0055 0.0062 0.0158
Mycobacterium ulcerans short chain dehydrogenase 0.0058 0.0109 0.0109
Plasmodium falciparum enoyl-acyl carrier reductase 0.0748 1 1
Schistosoma mansoni bcl-2 homologous antagonist/killer (bak) 0.0055 0.0062 0.0158
Giardia lamblia Dual specificity phosphatase, catalytic 0.0323 0.3906 0.5
Echinococcus granulosus EGFP:Bcl2 fusion protein 0.0688 0.9146 1
Echinococcus granulosus Bcl 2 ous antagonist:killer 0.0055 0.0062 0.0068
Trypanosoma cruzi oxidoreductase-like protein, putative 0.0058 0.0109 1
Plasmodium vivax enoyl-acyl carrier protein reductase 0.0748 1 1
Trichomonas vaginalis hypothetical protein 0.0748 1 0.5
Schistosoma mansoni dual specificity protein phosphatase 0.0323 0.3906 1
Wolbachia endosymbiont of Brugia malayi enoyl-ACP reductase 0.0748 1 1
Mycobacterium leprae NADH-DEPENDENT ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE INHA (NADH-DEPENDENT ENOYL-ACP REDUCTASE) 0.0748 1 1
Schistosoma mansoni apoptosis regulator bax 0.0055 0.0062 0.0158
Mycobacterium tuberculosis NADH-dependent enoyl-[acyl-carrier-protein] reductase InhA (NADH-dependent enoyl-ACP reductase) 0.0748 1 1
Entamoeba histolytica 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0051 0 0.5
Schistosoma mansoni hypothetical protein 0.0055 0.0062 0.0158
Schistosoma mansoni hypothetical protein 0.0055 0.0062 0.0158
Mycobacterium tuberculosis Probable oxidoreductase 0.0058 0.0109 0.0109
Leishmania major oxidoreductase-like protein 0.0058 0.0109 1
Onchocerca volvulus 0.0058 0.0109 0.028
Echinococcus multilocularis Bcl 2 ous antagonist:killer 0.0055 0.0062 0.0068
Plasmodium vivax multidrug resistance-associated protein 1, putative 0.0287 0.3391 0.3391
Brugia malayi Dual specificity phosphatase, catalytic domain containing protein 0.0323 0.3906 1
Echinococcus multilocularis EGFP:Bcl2 fusion protein 0.0688 0.9146 1
Mycobacterium ulcerans 3-alpha-hydroxysteroid dehydrogenase 0.0058 0.0109 0.0109
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0058 0.0109 0.0109
Loa Loa (eye worm) dual specificity phosphatase 0.0323 0.3906 1
Loa Loa (eye worm) apoptosis regulator protein 0.0055 0.0062 0.0158
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0058 0.0109 0.0109
Onchocerca volvulus 0.0323 0.3906 1

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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