Detailed information for compound 1477388

Basic information

Technical information
  • TDR Targets ID: 1477388
  • Name: 4-tert-butyl-N-(3-dimethylamino-2-methylpropy l)benzamide
  • MW: 276.417 | Formula: C17H28N2O
  • H donors: 1 H acceptors: 1 LogP: 3.7 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CN(CC(CNC(=O)c1ccc(cc1)C(C)(C)C)C)C
  • InChi: 1S/C17H28N2O/c1-13(12-19(5)6)11-18-16(20)14-7-9-15(10-8-14)17(2,3)4/h7-10,13H,11-12H2,1-6H3,(H,18,20)
  • InChiKey: BIPFMLQJRQXMPR-UHFFFAOYSA-N  

Network

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Synonyms

  • 4-tert-butyl-N-(3-dimethylamino-2-methyl-propyl)benzamide

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
Schistosoma mansoni hexokinase 0.0666 1 1
Echinococcus multilocularis hexokinase type 2 0.0666 1 1
Loa Loa (eye worm) hexokinase 0.0206 0.2714 0.2699
Entamoeba histolytica hexokinase 1 0.0666 1 0.5
Trypanosoma brucei hexokinase 0.0666 1 0.5
Brugia malayi Hexokinase family protein 0.0206 0.2714 0.2699
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0325 0.0305
Loa Loa (eye worm) hexokinase 0.0418 0.6069 0.606
Onchocerca volvulus 0.0286 0.3981 0.3968
Onchocerca volvulus 0.0666 1 1
Entamoeba histolytica hexokinase 2 0.0666 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0454 0.6646 0.6639
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0251 0.3431 0.3417
Toxoplasma gondii hexokinase 0.0666 1 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0325 0.0305
Echinococcus multilocularis hexokinase 0.0666 1 1
Echinococcus granulosus hexokinase 0.0666 1 1
Brugia malayi Hexokinase family protein 0.0418 0.6069 0.606
Loa Loa (eye worm) hexokinase type II 0.0666 1 1
Trypanosoma cruzi hexokinase, putative 0.0666 1 0.5
Onchocerca volvulus 0.0666 1 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0325 0.0305
Leishmania major hexokinase, putative 0.0666 1 0.5
Echinococcus granulosus histone lysine methyltransferase setb 0.0036 0.0021 0.0021
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.0325 0.0305
Brugia malayi Hexokinase family protein 0.0666 1 1
Onchocerca volvulus Hexokinase homolog 0.0418 0.6069 0.606
Trypanosoma brucei hexokinase, putative 0.0666 1 0.5
Trypanosoma cruzi hexokinase, putative 0.0666 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0212 0.2804 0.2789
Echinococcus multilocularis hexokinase 0.0666 1 1
Brugia malayi Pre-SET motif family protein 0.0251 0.3431 0.3417
Echinococcus granulosus hexokinase 0.0666 1 1
Echinococcus granulosus hexokinase 0.0666 1 1
Plasmodium vivax hexokinase, putative 0.0666 1 1
Trypanosoma brucei hexokinase 0.0666 1 0.5
Plasmodium falciparum hexokinase 0.0666 1 0.5
Leishmania major hexokinase, putative 0.0666 1 0.5
Loa Loa (eye worm) hexokinase 0.0666 1 1
Echinococcus granulosus hexokinase type 2 0.0666 1 1
Echinococcus multilocularis hexokinase 0.0666 1 1
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.0325 0.0305
Treponema pallidum hexokinase (hxk) 0.0666 1 0.5
Brugia malayi hexokinase type II 0.0212 0.2804 0.2789
Onchocerca volvulus 0.0418 0.6069 0.606
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0325 0.0325
Onchocerca volvulus 0.0666 1 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0325 0.0305
Loa Loa (eye worm) hexokinase 0.0666 1 1
Loa Loa (eye worm) hypothetical protein 0.0212 0.2804 0.2789
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0325 0.0325
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0325 0.0305
Trichomonas vaginalis set domain proteins, putative 0.0286 0.3981 0.5

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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