Detailed information for compound 1480477

Basic information

Technical information
  • TDR Targets ID: 1480477
  • Name: 1-[(1-tert-butyltetrazol-5-yl)-(3,4-dimethoxy phenyl)methyl]-4-ethylpiperazine
  • MW: 388.507 | Formula: C20H32N6O2
  • H donors: 0 H acceptors: 3 LogP: 2.14 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCN1CCN(CC1)C(c1nnnn1C(C)(C)C)c1ccc(c(c1)OC)OC
  • InChi: 1S/C20H32N6O2/c1-7-24-10-12-25(13-11-24)18(19-21-22-23-26(19)20(2,3)4)15-8-9-16(27-5)17(14-15)28-6/h8-9,14,18H,7,10-13H2,1-6H3
  • InChiKey: RWPDRRSKJTUEDJ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 1-[(1-tert-butyltetrazol-5-yl)-(3,4-dimethoxyphenyl)methyl]-4-ethyl-piperazine
  • 1-[(1-tert-butyl-5-tetrazolyl)-(3,4-dimethoxyphenyl)methyl]-4-ethylpiperazine
  • 1-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)-(3,4-dimethoxyphenyl)methyl]-4-ethyl-piperazine
  • ASN 05552482
  • Oprea1_461336

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 Glycosyl hydrolases family 31 protein 0.0038 0.0073 0.0073
Brugia malayi PAS domain containing protein 0.0047 0.0532 0.0532
Onchocerca volvulus Eukaryotic initiation factor 4A homolog 0.011 0.3437 1
Echinococcus granulosus lysosomal alpha glucosidase 0.0169 0.6212 1
Brugia malayi hypoxia-induced factor 1 0.0147 0.5163 0.5163
Schistosoma mansoni alpha glucosidase 0.0038 0.0073 0.0129
Trichomonas vaginalis alpha-glucosidase, putative 0.0038 0.0073 0.0211
Mycobacterium tuberculosis Probable reductase 0.0112 0.3545 0.8342
Echinococcus granulosus thioredoxin glutathione reductase 0.0049 0.0612 0.0985
Giardia lamblia Translation initiation factor eIF-4A, putative 0.011 0.3437 0.5
Plasmodium vivax RNA helicase-1, putative 0.011 0.3437 1
Loa Loa (eye worm) glutathione reductase 0.0049 0.0612 0.0612
Trypanosoma cruzi trypanothione reductase, putative 0.0049 0.0612 0.178
Mycobacterium tuberculosis Probable dehydrogenase 0.0112 0.3545 0.8342
Echinococcus multilocularis eukaryotic initiation factor 4A 0.011 0.3437 0.5532
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0052 0.0736 0.0736
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0125 0.4128 1
Brugia malayi Glycosyl hydrolases family 31 protein 0.0169 0.6212 0.6212
Echinococcus multilocularis eukaryotic initiation factor 4A III 0.011 0.3437 0.5532
Loa Loa (eye worm) hypothetical protein 0.0052 0.0736 0.0736
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0059 0.1081 0.174
Echinococcus granulosus muscleblind protein 0.0155 0.5556 0.8944
Trichomonas vaginalis alpha-glucosidase, putative 0.0038 0.0073 0.0211
Schistosoma mansoni DEAD box ATP-dependent RNA helicase 0.011 0.3437 0.611
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0038 0.0073 0.0211
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0038 0.0073 0.0211
Leishmania major alpha glucosidase II subunit, putative 0.0038 0.0073 0.0211
Mycobacterium ulcerans aldehyde dehydrogenase 0.0059 0.1081 1
Trichomonas vaginalis alpha-glucosidase, putative 0.0038 0.0073 0.0211
Echinococcus multilocularis muscleblind protein 1 0.0155 0.5556 0.8944
Schistosoma mansoni alpha-glucosidase 0.0146 0.5113 0.9091
Trichomonas vaginalis sucrase-isomaltase, putative 0.0038 0.0073 0.0211
Brugia malayi eukaryotic initiation factor 4A 0.011 0.3437 0.3437
Plasmodium falciparum eukaryotic initiation factor 4A 0.011 0.3437 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0052 0.0736 0.0736
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0038 0.0073 0.0211
Schistosoma mansoni aldehyde dehydrogenase 0.0059 0.1081 0.1922
Echinococcus multilocularis muscleblind protein 0.0155 0.5556 0.8944
Echinococcus granulosus eukaryotic initiation factor 4A III 0.011 0.3437 0.5532
Schistosoma mansoni single-minded 0.0047 0.0532 0.0946
Trypanosoma cruzi Eukaryotic initiation factor 4A-1 0.011 0.3437 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.0059 0.1081 1
Loa Loa (eye worm) hypothetical protein 0.011 0.3437 0.3437
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0038 0.0073 0.0073
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.0073 0.0211
Loa Loa (eye worm) thioredoxin reductase 0.0049 0.0612 0.0612
Echinococcus granulosus eukaryotic initiation factor 4A 0.011 0.3437 0.5532
Trichomonas vaginalis DEAD box ATP-dependent RNA helicase, putative 0.011 0.3437 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.0052 0.0736 0.0736
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0125 0.4128 1
Trichomonas vaginalis alpha-glucosidase, putative 0.0038 0.0073 0.0211
Brugia malayi glutathione reductase 0.0049 0.0612 0.0612
Loa Loa (eye worm) hypothetical protein 0.0155 0.5556 0.5556
Loa Loa (eye worm) hypothetical protein 0.0155 0.5556 0.5556
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0059 0.1081 0.3145
Entamoeba histolytica DEAD/DEAH box helicase, putative 0.011 0.3437 1
Schistosoma mansoni aryl hydrocarbon receptor 0.0047 0.0532 0.0946
Leishmania major eukaryotic initiation factor 4a, putative 0.011 0.3437 1
Toxoplasma gondii thioredoxin reductase 0.0049 0.0612 0.178
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0251 1 1
Trypanosoma brucei trypanothione reductase 0.0049 0.0612 0.178
Brugia malayi Thioredoxin reductase 0.0049 0.0612 0.0612
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0036 0 0.5
Echinococcus multilocularis lysosomal alpha glucosidase 0.0169 0.6212 1
Trichomonas vaginalis DEAD box ATP-dependent RNA helicase, putative 0.011 0.3437 1
Leishmania major trypanothione reductase 0.0049 0.0612 0.178
Leishmania major eukaryotic initiation factor 4a, putative 0.011 0.3437 1
Mycobacterium tuberculosis Probable cold-shock DeaD-box protein A homolog DeaD (ATP-dependent RNA helicase dead homolog) 0.011 0.3437 0.8034
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0112 0.3545 0.8342
Echinococcus multilocularis lysosomal alpha glucosidase 0.0169 0.6212 1
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0169 0.6212 0.6212
Echinococcus granulosus neutral alpha glucosidase AB 0.0038 0.0073 0.0117
Toxoplasma gondii eukaryotic initiation factor-4A, putative 0.011 0.3437 1
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0038 0.0073 0.0211
Brugia malayi hypothetical protein 0.0159 0.5738 0.5738
Echinococcus multilocularis neutral alpha glucosidase AB 0.0038 0.0073 0.0117
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0112 0.3545 0.8342
Treponema pallidum ATP-dependent RNA helicase 0.011 0.3437 0.5
Trichomonas vaginalis maltase-glucoamylase, putative 0.0038 0.0073 0.0211
Trypanosoma brucei Eukaryotic initiation factor 4A-1 0.011 0.3437 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.0059 0.1081 1
Trichomonas vaginalis alpha-glucosidase, putative 0.0038 0.0073 0.0211
Brugia malayi Muscleblind-like protein 0.0155 0.5556 0.5556
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0125 0.4128 1
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0038 0.0073 0.0211
Schistosoma mansoni alpha-glucosidase 0.0146 0.5113 0.9091
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0059 0.1081 0.174
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0059 0.1081 0.1334
Toxoplasma gondii aldehyde dehydrogenase 0.0059 0.1081 0.3145
Loa Loa (eye worm) hypoxia-induced factor 1 0.0147 0.5163 0.5163
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0112 0.3545 0.8342
Echinococcus multilocularis thioredoxin glutathione reductase 0.0049 0.0612 0.0985
Trypanosoma cruzi Eukaryotic initiation factor 4A-1 0.011 0.3437 1
Mycobacterium tuberculosis Probable oxidoreductase 0.0125 0.4128 1
Loa Loa (eye worm) hypothetical protein 0.0159 0.5738 0.5738
Schistosoma mansoni DEAD box ATP-dependent RNA helicase 0.011 0.3437 0.611
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.0073 0.0211
Trypanosoma brucei glucosidase, putative 0.0038 0.0073 0.0211
Schistosoma mansoni aldehyde dehydrogenase 0.0059 0.1081 0.1922
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0112 0.3545 0.8342
Trichomonas vaginalis DEAD box ATP-dependent RNA helicase, putative 0.011 0.3437 1

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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