Detailed information for compound 904505

Basic information

Technical information
  • TDR Targets ID: 904505
  • Name: 3,4,5-trimethoxy-N-[3-(trifluoromethyl)phenyl ]benzamide
  • MW: 355.308 | Formula: C17H16F3NO4
  • H donors: 1 H acceptors: 1 LogP: 3.56 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1cc(cc(c1OC)OC)C(=O)Nc1cccc(c1)C(F)(F)F
  • InChi: 1S/C17H16F3NO4/c1-23-13-7-10(8-14(24-2)15(13)25-3)16(22)21-12-6-4-5-11(9-12)17(18,19)20/h4-9H,1-3H3,(H,21,22)
  • InChiKey: OUGMXIDDVMFDMZ-UHFFFAOYSA-N  

Network

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Synonyms

  • ZINC00938984
  • EU-0068698
  • ST5183098

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 Smad1 0.0008 0.0355 0.0316
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0323 1
Brugia malayi F/Y-rich N-terminus family protein 0.001 0.0557 0.0519
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0323 1
Loa Loa (eye worm) MH2 domain-containing protein 0.0008 0.0355 0.0316
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0323 1
Loa Loa (eye worm) CXXC zinc finger family protein 0.0033 0.2621 0.2591
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.001 0.0569 0.0879
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0323 1
Brugia malayi MH1 domain containing protein 0.0008 0.0355 0.0316
Echinococcus granulosus mixed lineage leukemia protein mll 0.0008 0.0388 0.0135
Brugia malayi MH2 domain containing protein 0.0008 0.0355 0.0316
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0005 0.0076 0.0127
Brugia malayi MH2 domain containing protein 0.0008 0.0355 0.0316
Plasmodium falciparum zinc finger protein, putative 0.0004 0 0.5
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0323 1
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0323 1
Schistosoma mansoni cpg binding protein 0.0035 0.279 0.4688
Loa Loa (eye worm) MH1 domain-containing protein 0.0008 0.0355 0.0316
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0008 0.0388 0.0135
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.001 0.0569 0.0879
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0323 1
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0008 0.0323 1
Schistosoma mansoni smad1 5 8 and 0.0008 0.0355 0.0596
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0323 1
Brugia malayi MH1 domain containing protein 0.0008 0.0355 0.0316
Echinococcus granulosus cpg binding protein 0.0035 0.279 1
Loa Loa (eye worm) Smad1 0.0008 0.0355 0.0316
Trichomonas vaginalis helicase, putative 0.0008 0.0323 1
Loa Loa (eye worm) MH2 domain-containing protein 0.0116 1 1
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0008 0.0388 0.0135
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0323 1
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0008 0.0323 1
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0071 0.5951 1
Entamoeba histolytica hypothetical protein 0.0004 0 0.5
Schistosoma mansoni smad1 5 8 and 0.0008 0.0355 0.0596
Echinococcus multilocularis cpg binding protein 0.0035 0.279 1
Loa Loa (eye worm) transcription factor SMAD2 0.0116 1 1
Toxoplasma gondii histone lysine methyltransferase SET1 0.0063 0.5278 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0323 1
Schistosoma mansoni cpg binding protein 0.0035 0.279 0.4688
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0323 1
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0008 0.0388 0.0135
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0323 1
Brugia malayi CXXC zinc finger family protein 0.0033 0.2621 0.2591
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0008 0.0388 0.0651
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0323 1
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0008 0.0355 0.0596
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0323 1
Onchocerca volvulus 0.0033 0.2621 0.5
Loa Loa (eye worm) histone methyltransferase 0.001 0.0569 0.0531
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0323 1
Schistosoma mansoni smad1 5 8 and 0.0008 0.0355 0.0596
Schistosoma mansoni Smad4 0.0008 0.0355 0.0596
Schistosoma mansoni smad 0.0008 0.0355 0.0596
Schistosoma mansoni cpg binding protein 0.0033 0.2621 0.4403

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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