Detailed information for compound 902709

Basic information

Technical information
  • TDR Targets ID: 902709
  • Name: 2-(4-bromophenoxy)-N-[[3-(3-methylphenyl)-1,2 ,4-oxadiazol-5-yl]methyl]acetamide
  • MW: 402.242 | Formula: C18H16BrN3O3
  • H donors: 1 H acceptors: 3 LogP: 3.7 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(COc1ccc(cc1)Br)NCc1onc(n1)c1cccc(c1)C
  • InChi: 1S/C18H16BrN3O3/c1-12-3-2-4-13(9-12)18-21-17(25-22-18)10-20-16(23)11-24-15-7-5-14(19)6-8-15/h2-9H,10-11H2,1H3,(H,20,23)
  • InChiKey: OGKUCVPJGCNXEA-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 2-(4-bromophenoxy)-N-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamide
  • ZINC04512620
  • STK300908
  • 2-(4-Bromo-phenoxy)-N-(3-m-tolyl-[1,2,4]oxadiazol-5-ylmethyl)-acetamide
  • BAS 13151376

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
Entamoeba histolytica hypothetical protein 0.004 0.1668 0.9642
Plasmodium falciparum thymidylate kinase 0.0041 0.1726 0.4873
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.138 0.1355
Entamoeba histolytica hypothetical protein 0.0035 0.138 0.7842
Entamoeba histolytica hypothetical protein 0.004 0.1668 0.9642
Wolbachia endosymbiont of Brugia malayi thymidylate kinase 0.0041 0.1726 1
Brugia malayi Pre-SET motif family protein 0.0152 0.844 0.8695
Giardia lamblia CDC8 0.0041 0.1726 1
Giardia lamblia Hypothetical protein 0.004 0.1668 0.9642
Entamoeba histolytica hypothetical protein 0.004 0.1668 0.9642
Entamoeba histolytica hypothetical protein 0.004 0.1668 0.9642
Loa Loa (eye worm) hypothetical protein 0.0026 0.085 0.0877
Mycobacterium tuberculosis Thymidylate kinase Tmk (dTMP kinase) (thymidylic acid kinase) (TMPK) 0.0041 0.1726 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0031 0.1139 0.1113
Loa Loa (eye worm) hypothetical protein 0.0069 0.3409 0.3518
Onchocerca volvulus 0.0035 0.139 0.0888
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0021 0.0531 0.0504
Echinococcus multilocularis lamin 0.0026 0.085 0.0823
Trichomonas vaginalis thymidylate kinase, putative 0.0041 0.1726 0.167
Loa Loa (eye worm) intermediate filament protein 0.0026 0.085 0.0877
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.0069 0.3409 0.3442
Schistosoma mansoni hypothetical protein 0.0069 0.3409 0.3326
Schistosoma mansoni thymidylate kinase 0.0041 0.1726 0.1621
Plasmodium falciparum carbonic anhydrase 0.0069 0.3409 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0022 0.058 0.046
Loa Loa (eye worm) hypothetical protein 0.0022 0.058 0.0598
Onchocerca volvulus 0.0026 0.085 0.0296
Trypanosoma cruzi UMP-CMP kinase, mitochondrial, putative 0.0016 0.023 0.0131
Brugia malayi hypothetical protein 0.0172 0.969 1
Loa Loa (eye worm) deoxynucleoside kinase 0.004 0.1668 0.1722
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0031 0.1139 0.1113
Leishmania major thymidylate kinase-like protein 0.0041 0.1726 0.201
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0069 0.3409 0.3442
Entamoeba histolytica deoxyuridine 5-triphosphate nucleotidohydrolase domain containing protein 0.004 0.1668 0.9642
Schistosoma mansoni lamin 0.0026 0.085 0.0734
Entamoeba histolytica hypothetical protein 0.0035 0.138 0.7842
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.0146 0.8089 1
Echinococcus granulosus histone lysine methyltransferase setb 0.0022 0.058 0.0552
Toxoplasma gondii hypothetical protein 0.0069 0.3409 1
Schistosoma mansoni survival motor neuron protein 0.0035 0.139 0.1281
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0022 0.058 0.046
Trypanosoma brucei thymidylate kinase, putative 0.0041 0.1726 0.201
Trichomonas vaginalis conserved hypothetical protein 0.004 0.1668 0.161
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.0069 0.3409 0.3518
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0022 0.058 0.0552
Echinococcus multilocularis lamin dm0 0.0026 0.085 0.0823
Entamoeba histolytica deoxyuridine 5-triphosphate nucleotidohydrolase domain containing protein 0.004 0.1668 0.9642
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0026 0.085 0.0877
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0022 0.058 0.046
Onchocerca volvulus 0.0173 0.9708 1
Entamoeba histolytica hypothetical protein 0.004 0.1668 0.9642
Loa Loa (eye worm) hypothetical protein 0.0069 0.3409 0.3518
Entamoeba histolytica deoxyuridine 5-triphosphate nucleotidohydrolase domain containing protein 0.004 0.1668 0.9642
Entamoeba histolytica hypothetical protein 0.0035 0.138 0.7842
Schistosoma mansoni NADH-ubiquinone oxidoreductase 0.004 0.1668 0.1563
Leishmania major hypothetical protein, conserved 0.0016 0.023 0.0131
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0035 0.139 0.1333
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0031 0.1139 0.1027
Giardia lamblia Deoxynucleoside kinase 0.004 0.1668 0.9642
Echinococcus granulosus lamin dm0 0.0026 0.085 0.0823
Schistosoma mansoni carbonic anhydrase-related 0.0069 0.3409 0.3326
Echinococcus multilocularis NADH ubiquinone oxidoreductase 42 kDa subunit 0.004 0.1668 0.1644
Schistosoma mansoni carbonic anhydrase-related 0.0069 0.3409 0.3326
Entamoeba histolytica hypothetical protein 0.004 0.1668 0.9642
Echinococcus granulosus carbonic anhydrase 0.0069 0.3409 0.339
Echinococcus granulosus survival motor neuron protein 1 0.0172 0.969 0.9689
Echinococcus multilocularis transfer RNA-Ile 0.0178 1 1
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.138 0.1271
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.138 0.1355
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0014 0.0125 0.0096
Echinococcus multilocularis carbonic anhydrase 0.0069 0.3409 0.339
Brugia malayi Intermediate filament tail domain containing protein 0.0026 0.085 0.0769
Echinococcus multilocularis thymidylate kinase 0.0041 0.1726 0.1701
Giardia lamblia Hypothetical protein 0.004 0.1668 0.9642
Loa Loa (eye worm) hypothetical protein 0.0026 0.0821 0.0847
Trypanosoma cruzi thymidylate kinase, putative 0.0041 0.1726 0.201
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0022 0.058 0.1384
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0014 0.0125 0.0096
Loa Loa (eye worm) hypothetical protein 0.0069 0.3409 0.3518
Brugia malayi Pre-SET motif family protein 0.0022 0.058 0.0487
Echinococcus granulosus carbonic anhydrase II 0.0146 0.8089 0.8084
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0022 0.058 0.046
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0031 0.1139 0.1071
Echinococcus multilocularis thymidine kinase 0.0178 1 1
Treponema pallidum thymidylate kinase (tmk) 0.0041 0.1726 1
Schistosoma mansoni thymidine kinase 0.0178 1 1
Entamoeba histolytica hypothetical protein 0.004 0.1668 0.9642
Schistosoma mansoni carbonic anhydrase 0.0069 0.3409 0.3326
Echinococcus granulosus intermediate filament protein 0.0026 0.085 0.0823
Plasmodium vivax thymidylate kinase, putative 0.0041 0.1726 1
Entamoeba histolytica hypothetical protein 0.004 0.1668 0.9642
Echinococcus granulosus thymidylate kinase 0.0041 0.1726 0.1701
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0152 0.844 0.871
Entamoeba histolytica hypothetical protein 0.0035 0.138 0.7842
Entamoeba histolytica hypothetical protein 0.004 0.1668 0.9642
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0031 0.1139 0.1113
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0031 0.1139 0.1027
Echinococcus multilocularis carbonic anhydrase 0.0069 0.3409 0.339
Echinococcus multilocularis carbonic anhydrase II 0.0146 0.8089 0.8084
Trichomonas vaginalis thymidylate kinase, putative 0.0041 0.1726 0.167
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.0069 0.3409 0.3442
Trichomonas vaginalis conserved hypothetical protein 0.004 0.1668 0.161
Schistosoma mansoni hypothetical protein 0.0041 0.1726 0.1621
Onchocerca volvulus 0.0026 0.085 0.0296
Mycobacterium ulcerans thymidylate kinase 0.0041 0.1726 1
Echinococcus multilocularis musashi 0.0026 0.085 0.0823
Leishmania major carbonic anhydrase-like protein 0.0146 0.8089 1
Echinococcus granulosus thymidine kinase 0.0178 1 1
Trypanosoma brucei carbonic anhydrase-like protein 0.0146 0.8089 1
Loa Loa (eye worm) carbonic anhydrase 3 0.0146 0.8089 0.8348
Loa Loa (eye worm) hypothetical protein 0.0172 0.969 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0031 0.1139 0.1113
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0014 0.0125 0.0129
Loa Loa (eye worm) hypothetical protein 0.0013 0.0029 0.003
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0146 0.8089 0.8328
Trypanosoma cruzi UMP-CMP kinase, mitochondrial, putative 0.0016 0.023 0.0131
Trichomonas vaginalis set domain proteins, putative 0.0173 0.9708 1
Chlamydia trachomatis thymidylate kinase 0.0041 0.1726 0.5
Schistosoma mansoni thymidylate kinase 0.0041 0.1726 0.1621
Mycobacterium leprae probable thymidylate kinase Tmk (dTMP KINASE) (THYMIDYLIC ACID KINASE) (TMPK) 0.0041 0.1726 0.5
Brugia malayi hypothetical protein 0.0035 0.138 0.1323
Trichomonas vaginalis conserved hypothetical protein 0.004 0.1668 0.161
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.0146 0.8089 0.8065
Brugia malayi Deoxynucleoside kinase family protein 0.004 0.1668 0.1624
Schistosoma mansoni intermediate filament proteins 0.0026 0.085 0.0734
Schistosoma mansoni lamin 0.0026 0.085 0.0734
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.0146 0.8089 1
Giardia lamblia Deoxyguanosine kinase/deoxyadenosine kinase subunit, putative 0.004 0.1668 0.9642
Schistosoma mansoni hypothetical protein 0.0035 0.139 0.1281
Trypanosoma cruzi thymidylate kinase, putative 0.0041 0.1726 0.201
Echinococcus multilocularis survival motor neuron protein 1 0.0172 0.969 0.9689
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.0146 0.8089 0.8065
Echinococcus granulosus carbonic anhydrase 0.0069 0.3409 0.339
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0014 0.0113 0.0117
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0031 0.1139 0.1027
Trichomonas vaginalis conserved hypothetical protein 0.004 0.1668 0.161
Schistosoma mansoni hypothetical protein 0.0035 0.138 0.1271
Loa Loa (eye worm) thymidylate kinase 0.0041 0.1726 0.1781
Echinococcus granulosus NADH ubiquinone oxidoreductase 42 kDa subunit 0.004 0.1668 0.1644
Toxoplasma gondii thymidylate kinase 0.0041 0.1726 0.4873
Echinococcus granulosus lamin 0.0026 0.085 0.0823
Brugia malayi exodeoxyribonuclease III family protein 0.0014 0.0125 0.0012
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0069 0.3409 0.3442
Onchocerca volvulus Putative thymidylate kinase 0.0041 0.1726 0.1255
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0069 0.3409 0.3442
Brugia malayi intermediate filament protein 0.0026 0.085 0.0769
Trichomonas vaginalis conserved hypothetical protein 0.004 0.1668 0.161
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0031 0.1139 0.1175
Echinococcus multilocularis thymidine kinase 0.0178 1 1
Trypanosoma brucei thymidylate kinase, putative 0.0041 0.1726 0.201
Echinococcus granulosus carbonic anhydrase 0.0069 0.3409 0.339
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0022 0.058 0.0552
Plasmodium vivax SET domain protein, putative 0.0022 0.058 0.284
Echinococcus granulosus Thymidine kinase 2 mitochondrial 0.0178 1 1
Schistosoma mansoni carbonic anhydrase-related 0.0069 0.3409 0.3326
Brugia malayi thymidylate kinase 0.0041 0.1726 0.1684
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.0146 0.8089 0.8348
Entamoeba histolytica Thymidylate kinase, putative 0.0041 0.1726 1
Entamoeba histolytica deoxyuridine 5-triphosphate nucleotidohydrolase domain containing protein 0.004 0.1668 0.9642
Brugia malayi Putative carbonic anhydrase 5 precursor 0.0146 0.8089 0.8328
Echinococcus multilocularis carbonic anhydrase 0.0069 0.3409 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:

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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