Detailed information for compound 1845044

Basic information

Technical information
  • TDR Targets ID: 1845044
  • Name: 5-tert-butyl-N-[2-[4-(2-ethoxyethyl)-2-methyl phenoxy]ethyl]-2-methyl-N-propanoylpyrazole-3 -carboxamide
  • MW: 443.579 | Formula: C25H37N3O4
  • H donors: 0 H acceptors: 3 LogP: 4.5 Rotable bonds: 13
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOCCc1ccc(c(c1)C)OCCN(C(=O)c1cc(nn1C)C(C)(C)C)C(=O)CC
  • InChi: 1S/C25H37N3O4/c1-8-23(29)28(24(30)20-17-22(25(4,5)6)26-27(20)7)13-15-32-21-11-10-19(16-18(21)3)12-14-31-9-2/h10-11,16-17H,8-9,12-15H2,1-7H3
  • InChiKey: GGQKOUJQZWTLSE-UHFFFAOYSA-N  

Network

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Synonyms

  • 5-tert-butyl-N-[2-[4-(2-ethoxyethyl)-2-methyl-phenoxy]ethyl]-2-methyl-N-propanoyl-pyrazole-3-carboxamide
  • 5-tert-butyl-N-[2-[4-(2-ethoxyethyl)-2-methylphenoxy]ethyl]-2-methyl-N-(1-oxopropyl)-3-pyrazolecarboxamide
  • 5-tert-butyl-N-[2-[4-(2-ethoxyethyl)-2-methyl-phenoxy]ethyl]-2-methyl-N-propionyl-pyrazole-3-carboxamide

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
Plasmodium falciparum cell division cycle protein 48 homologue, putative 0.0449 0.9457 1
Trichomonas vaginalis spermatogenesis associated factor, putative 0.0474 1 1
Toxoplasma gondii cell division protein CDC48CY 0.0474 1 1
Schistosoma mansoni cell division control protein 48 aaa family protein 0.0449 0.9457 0.9457
Entamoeba histolytica cdc48-like protein, putative 0.0449 0.9457 1
Toxoplasma gondii transitional endoplasmic reticulum ATPase, putative 0.0283 0.5767 0.5767
Entamoeba histolytica transitional endoplasmic reticulum ATPase, putative 0.0449 0.9457 1
Brugia malayi MH2 domain containing protein 0.0115 0.2024 0.3589
Trypanosoma cruzi katanin, putative 0.0024 0.0000041468 0.0000043848
Mycobacterium ulcerans ATPase 0.0283 0.5767 0.5
Brugia malayi ATPase, AAA family protein 0.0024 0.0000041468 0.0000073523
Onchocerca volvulus Transitional endoplasmic reticulum ATPase homolog 0.0474 1 1
Trypanosoma cruzi vacuolar protein sorting-associated protein 4, putative 0.0024 0.0000041468 0.0000043848
Loa Loa (eye worm) fidgetin protein 0.0024 0.0000041468 0.0000073523
Brugia malayi valosin containing protein 0.0278 0.564 1
Loa Loa (eye worm) VCP protein 0.0196 0.3817 0.6768
Leishmania major Transitional endoplasmic reticulum ATPase, putative,valosin-containing protein homolog 0.0449 0.9457 1
Trypanosoma cruzi katanin-like protein, putative 0.0024 0.0000041468 0.0000043848
Schistosoma mansoni cell division control protein 48 aaa family protein 0.0474 1 1
Trichomonas vaginalis 26S protease regulatory subunit S10b, putative 0.0112 0.195 0.195
Loa Loa (eye worm) vesicle-fusing ATPase 0.0278 0.564 1
Brugia malayi vps4b-prov protein 0.0024 0.0000041468 0.0000073523
Brugia malayi vesicle-fusing ATPase 0.0278 0.564 1
Trypanosoma cruzi metalloprotease, putative 0.0024 0.0000041468 0.0000043848
Loa Loa (eye worm) transcription factor SMAD2 0.0115 0.2024 0.3589
Brugia malayi transitional endoplasmic reticulum ATPase TER94, putative 0.0196 0.3817 0.6768
Loa Loa (eye worm) ATPase 0.0024 0.0000041468 0.0000073523
Trypanosoma cruzi katanin, putative 0.0024 0.0000041468 0.0000043848
Echinococcus multilocularis transitional endoplasmic reticulum atpase 0.0474 1 1
Trypanosoma cruzi katanin, putative 0.0024 0.0000041468 0.0000043848
Loa Loa (eye worm) hypothetical protein 0.0278 0.564 1
Trichomonas vaginalis proteasome-activating nucleotidase, putative 0.0112 0.195 0.195
Trypanosoma cruzi katanin, putative 0.0024 0.0000041468 0.0000043848
Plasmodium vivax cell division cycle protein 48 homologue, putative 0.0449 0.9457 1
Loa Loa (eye worm) MH2 domain-containing protein 0.0115 0.2024 0.3589
Toxoplasma gondii cell division protein CDC48AP 0.0283 0.5767 0.5767
Trypanosoma cruzi Valosin-containing protein, putative 0.0449 0.9457 1
Schistosoma mansoni cell division control protein 48 aaa family protein 0.0196 0.3817 0.3817
Trypanosoma cruzi katanin, putative 0.0024 0.0000041468 0.0000043848
Mycobacterium tuberculosis Putative conserved ATPase 0.0283 0.5767 0.5
Echinococcus multilocularis transitional endoplasmic reticulum atpase 0.0196 0.3817 0.3817
Giardia lamblia AAA family ATPase 0.0283 0.5767 1
Trypanosoma brucei Valosin-containing protein 0.0449 0.9457 1
Trypanosoma cruzi vacuolar transport protein 4A, putative 0.0024 0.0000041468 0.0000043848
Trypanosoma cruzi vesicular transport protein (CDC48 homologue), putative 0.0024 0.0000041468 0.0000043848

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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