Detailed information for compound 578292

Basic information

Technical information
  • TDR Targets ID: 578292
  • Name: N-(2-morpholinoethyl)-2-(trifluoromethyl)benz enesulfonamide
  • MW: 338.346 | Formula: C13H17F3N2O3S
  • H donors: 1 H acceptors: 2 LogP: 1.44 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=S(=O)(c1ccccc1C(F)(F)F)NCCN1CCOCC1
  • InChi: 1S/C13H17F3N2O3S/c14-13(15,16)11-3-1-2-4-12(11)22(19,20)17-5-6-18-7-9-21-10-8-18/h1-4,17H,5-10H2
  • InChiKey: LESRBIWJVFJQSB-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-(2-morpholin-4-ylethyl)-2-(trifluoromethyl)benzenesulfonamide

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Mycobacterium tuberculosis NADH-dependent enoyl-[acyl-carrier-protein] reductase InhA (NADH-dependent enoyl-ACP reductase) Curated by TDR Targets References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Toxoplasma gondii enoyl-acyl carrier reductase ENR Get druggable targets OG5_130466 All targets in OG5_130466
Plasmodium berghei enoyl-acyl carrier reductase Get druggable targets OG5_130466 All targets in OG5_130466
Plasmodium falciparum enoyl-acyl carrier reductase Get druggable targets OG5_130466 All targets in OG5_130466
Mycobacterium ulcerans enoyl-(acyl carrier protein) reductase Get druggable targets OG5_130466 All targets in OG5_130466
Plasmodium knowlesi enoyl-acyl carrier reductase, putative Get druggable targets OG5_130466 All targets in OG5_130466
Neospora caninum enoyl-acyl carrier reductase, putative Get druggable targets OG5_130466 All targets in OG5_130466
Mycobacterium leprae NADH-DEPENDENT ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE INHA (NADH-DEPENDENT ENOYL-ACP REDUCTASE) Get druggable targets OG5_130466 All targets in OG5_130466
Mycobacterium tuberculosis NADH-dependent enoyl-[acyl-carrier-protein] reductase InhA (NADH-dependent enoyl-ACP reductase) Get druggable targets OG5_130466 All targets in OG5_130466
Wolbachia endosymbiont of Brugia malayi enoyl-ACP reductase Get druggable targets OG5_130466 All targets in OG5_130466
Plasmodium yoelii enoyl-acyl carrier reductase Get druggable targets OG5_130466 All targets in OG5_130466
Plasmodium vivax enoyl-acyl carrier protein reductase Get druggable targets OG5_130466 All targets in OG5_130466
Chlamydia trachomatis enoyl-acyl-carrier protein reductase Get druggable targets OG5_130466 All targets in OG5_130466
Trichomonas vaginalis hypothetical protein Get druggable targets OG5_130466 All targets in OG5_130466
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
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0037 0.0852 0.97
Schistosoma mansoni hypothetical protein 0.0298 1 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0094 0.2861 0.2788
Loa Loa (eye worm) inositol-1 0.0037 0.0852 0.0852
Echinococcus granulosus importin subunit beta 1 0.0028 0.0548 0.0532
Schistosoma mansoni inositol monophosphatase 0.0037 0.0852 0.0759
Brugia malayi Importin beta-1 subunit 0.0028 0.0548 0.0726
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0037 0.0875 1
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0026 0.0495 0.0495
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0037 0.0875 1
Toxoplasma gondii HEAT repeat-containing protein 0.0028 0.0548 0.0614
Trichomonas vaginalis set domain proteins, putative 0.0232 0.769 1
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0037 0.0875 1
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0037 0.0875 0.0875
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0204 0.6704 0.6704
Toxoplasma gondii enoyl-acyl carrier reductase ENR 0.0223 0.7388 1
Brugia malayi intermediate filament protein 0.0026 0.0495 0.0646
Schistosoma mansoni ran 0.0021 0.029 0.0192
Echinococcus granulosus 3 oxoacyl acyl carrier protein reductase 0.0015 0.01 0.0083
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0021 0.029 0.0273
Onchocerca volvulus 0.0232 0.769 1
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0037 0.0852 0.97
Trichomonas vaginalis hypothetical protein 0.0223 0.7388 0.9592
Echinococcus multilocularis snurportin 1 0.0298 1 1
Echinococcus granulosus GTP binding nuclear protein Ran 0.0021 0.029 0.0273
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0021 0.029 0.0337
Schistosoma mansoni lamin 0.0026 0.0495 0.0399
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0094 0.2861 0.2788
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0037 0.0875 0.1064
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0094 0.2861 0.2849
Plasmodium vivax enoyl-acyl carrier protein reductase 0.0223 0.7388 1
Echinococcus granulosus inositol monophosphatase 1 0.0037 0.0852 0.0837
Loa Loa (eye worm) hypothetical protein 0.0013 0.0017 0.0017
Toxoplasma gondii exonuclease III APE 0.0037 0.0875 0.1064
Trypanosoma brucei importin beta-1 subunit, putative 0.0028 0.0548 0.5774
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0015 0.01 0.0052
Loa Loa (eye worm) hypothetical protein 0.0026 0.0478 0.0478
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0094 0.2861 0.2849
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0094 0.2861 0.2849
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0094 0.2861 0.2861
Trichomonas vaginalis ap endonuclease, putative 0.0037 0.0875 0.0791
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0037 0.0852 0.1032
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0029 0.0594 0.0578
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0298 1 1
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0037 0.0852 0.1032
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0037 0.0875 0.086
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0094 0.2861 0.2788
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0094 0.2861 0.2849
Schistosoma mansoni ap endonuclease 0.0037 0.0875 0.0783
Loa Loa (eye worm) hypothetical protein 0.0029 0.0594 0.0594
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.0033 0.0718 0.0848
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0037 0.0852 0.1032
Brugia malayi exodeoxyribonuclease III family protein 0.0037 0.0875 0.1219
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0037 0.0875 1
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0033 0.0718 0.0848
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0021 0.029 0.2446
Chlamydia trachomatis enoyl-acyl-carrier protein reductase 0.0223 0.7388 1
Echinococcus multilocularis 3 oxoacyl acyl carrier protein reductase 0.0015 0.01 0.0083
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0015 0.01 0.01
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0037 0.0875 0.1064
Leishmania major GTP-binding protein, putative 0.0021 0.029 0.2446
Echinococcus granulosus lamin 0.0026 0.0495 0.0479
Loa Loa (eye worm) hypothetical protein 0.0015 0.01 0.01
Entamoeba histolytica Ran family GTPase 0.0021 0.029 0.2446
Echinococcus granulosus histone lysine methyltransferase setb 0.0029 0.0594 0.0578
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0029 0.0594 0.0578
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0594 0.0499
Echinococcus multilocularis musashi 0.0026 0.0495 0.0479
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0037 0.0875 1
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0028 0.0556 0.054
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0021 0.029 0.026
Schistosoma mansoni ap endonuclease 0.0037 0.0875 0.0783
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0021 0.029 0.2446
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0594 0.0499
Echinococcus granulosus lamin dm0 0.0026 0.0495 0.0479
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0015 0.01 0.0052
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0594 0.0499
Trichomonas vaginalis ap endonuclease, putative 0.0037 0.0875 0.0791
Onchocerca volvulus 0.0026 0.0495 0.052
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0037 0.0875 0.086
Trypanosoma cruzi importin beta-1 subunit, putative 0.0023 0.0363 0.339
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0021 0.029 0.026
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0037 0.0875 0.1064
Brugia malayi Pre-SET motif family protein 0.0204 0.6704 1
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0014 0.0066 0.0066
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0029 0.0594 0.0499
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0037 0.0875 0.1064
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0037 0.0852 0.97
Onchocerca volvulus 0.0029 0.0594 0.0651
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0037 0.0875 0.1064
Trichomonas vaginalis importin beta-1, putative 0.0023 0.0363 0.0099
Treponema pallidum exodeoxyribonuclease (exoA) 0.0037 0.0875 0.5
Schistosoma mansoni importin beta-1 0.0028 0.0548 0.0452
Brugia malayi Inositol-1 0.0037 0.0852 0.1184
Brugia malayi Intermediate filament tail domain containing protein 0.0026 0.0495 0.0646
Wolbachia endosymbiont of Brugia malayi enoyl-ACP reductase 0.0223 0.7388 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0094 0.2861 0.421
Echinococcus granulosus intermediate filament protein 0.0026 0.0495 0.0479
Onchocerca volvulus 0.0026 0.0495 0.052
Schistosoma mansoni intermediate filament proteins 0.0026 0.0495 0.0399
Trypanosoma brucei importin beta-1 subunit, putative 0.0028 0.0548 0.5774
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0037 0.0852 0.076
Brugia malayi Pre-SET motif family protein 0.0029 0.0594 0.0795
Echinococcus multilocularis inositol monophosphatase 1 0.0037 0.0852 0.0837
Plasmodium vivax SET domain protein, putative 0.0029 0.0594 0.0678
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0037 0.0875 1
Plasmodium falciparum importin beta, putative 0.0028 0.0548 0.0614
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0021 0.029 0.2446
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0037 0.0852 0.076
Leishmania major importin beta-1 subunit, putative 0.0023 0.0363 0.339
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0021 0.029 0.026
Mycobacterium leprae NADH-DEPENDENT ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE INHA (NADH-DEPENDENT ENOYL-ACP REDUCTASE) 0.0223 0.7388 1
Loa Loa (eye worm) oxidoreductase 0.0015 0.01 0.01
Schistosoma mansoni lamin 0.0026 0.0495 0.0399
Schistosoma mansoni ran 0.0021 0.029 0.0192
Echinococcus multilocularis lamin dm0 0.0026 0.0495 0.0479
Trichomonas vaginalis inositol monophosphatase, putative 0.0037 0.0852 0.076
Loa Loa (eye worm) retinol dehydrogenase 12 0.0015 0.01 0.01
Plasmodium falciparum enoyl-acyl carrier reductase 0.0223 0.7388 1
Echinococcus multilocularis importin subunit beta 1 0.0028 0.0548 0.0532
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0023 0.0363 0.0099
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0037 0.0852 0.97
Loa Loa (eye worm) hypothetical protein 0.0028 0.0548 0.0548
Mycobacterium tuberculosis NADH-dependent enoyl-[acyl-carrier-protein] reductase InhA (NADH-dependent enoyl-ACP reductase) 0.0223 0.7388 1
Loa Loa (eye worm) hypothetical protein 0.0026 0.0495 0.0495
Plasmodium vivax importin-beta 2, putative 0.0028 0.0548 0.0614
Loa Loa (eye worm) intermediate filament protein 0.0026 0.0495 0.0495
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0021 0.029 0.029
Mycobacterium ulcerans enoyl-(acyl carrier protein) reductase 0.0223 0.7388 1
Echinococcus multilocularis lamin 0.0026 0.0495 0.0479
Brugia malayi RNA, U transporter 1 0.0079 0.2349 0.3439
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0023 0.0363 0.0099
Schistosoma mansoni inositol monophosphatase 0.0037 0.0852 0.0759
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0037 0.0852 0.97
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0029 0.0594 0.0678
Entamoeba histolytica hypothetical protein 0.0023 0.0363 0.339

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:

Affected Entity Phenotypic quality Occurs in Occurs at Evidence Observed in Targets
catalytic activity (GO:0003824) decreased (PATO:0000468) in vitro (MI:0492) inferred from specific protein inhibition (ECO:0000020) Mycobacterium tuberculosis 6263  
Annotator: crowther@u.washington.edu Comment: 2007-12-06 References: 17034137 17227913
growth (GO:0040007) decreased (PATO:0000468) inferred from in vitro culture assay (ECO:0000182) Mycobacterium tuberculosis 6263  
Annotator: crowther@u.washington.edu Comment: 2007-12-06 References: 17034137

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

2 literature references were collected for this gene.

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