TDR Targets

Basic information

Technical information

TDR Targets ID: 56639
Name: N-(2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3- yl)acetamide
MW: 226.315 | Formula: C12H22N2O2
H donors: 1 H acceptors: 1 LogP: 0.43 Rotable bonds: 2
Rule of 5 violations (Lipinski): 1
SMILES: CN1CCC2(CC1)CC(C(O2)C)NC(=O)C
InChi: 1S/C12H22N2O2/c1-9-11(13-10(2)15)8-12(16-9)4-6-14(3)7-5-12/h9,11H,4-8H2,1-3H3,(H,13,15)
InChiKey: PLBXTZUSCKEVEQ-UHFFFAOYSA-N

Network

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Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

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Clustering layers

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Synonyms

N-(2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-yl)ethanamide

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

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus granulosus	lamin	0.0031	0.051	0.0659
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0041	0.0785	0.1085
Onchocerca volvulus		0.0031	0.051	0.0781
Onchocerca volvulus		0.0084	0.1918	0.2936
Trypanosoma brucei	adenosine monophosphate deaminase, putative	0.0084	0.1918	0.5
Trypanosoma cruzi	AMP deaminase 2, putative	0.0084	0.1918	0.5
Entamoeba histolytica	AMP deaminase, putative	0.0084	0.1918	0.1972
Treponema pallidum	adenosine deaminase	0.0258	0.6533	0.5
Loa Loa (eye worm)	AMP deaminase	0.0084	0.1918	0.286
Leishmania major	adenine aminohydrolase	0.0258	0.6533	1
Toxoplasma gondii	Adenosine/AMP deaminase domain-containing protein	0.0258	0.6533	1
Echinococcus granulosus	geminin	0.0195	0.4852	0.7393
Loa Loa (eye worm)	hypothetical protein	0.0174	0.4303	0.655
Schistosoma mansoni	transcription factor LCR-F1	0.0041	0.0785	0.0289
Loa Loa (eye worm)	hypothetical protein	0.003	0.0495	0.0658
Echinococcus multilocularis	musashi	0.0031	0.051	0.0659
Trypanosoma cruzi	AMP deaminase, putative	0.0084	0.1918	0.5
Trichomonas vaginalis	adenosine deaminase, putative	0.0258	0.6533	0.5
Entamoeba histolytica	adenosine deaminase, putative	0.0258	0.6533	1
Loa Loa (eye worm)	intermediate filament protein	0.0031	0.051	0.0681
Echinococcus granulosus	lamin dm0	0.0031	0.051	0.0659
Trypanosoma cruzi	adenosine monophosphate deaminase-like protein, putative	0.0084	0.1918	0.5
Schistosoma mansoni	hypothetical protein	0.0195	0.4852	0.4576
Mycobacterium tuberculosis	Probable adenosine deaminase Add (adenosine aminohydrolase)	0.0258	0.6533	0.5
Echinococcus granulosus	adenosine deaminase	0.0258	0.6533	1
Brugia malayi	Adenosine/AMP deaminase family protein	0.0258	0.6533	1
Echinococcus multilocularis	lamin dm0	0.0031	0.051	0.0659
Trichomonas vaginalis	adenosine deaminase, putative	0.0258	0.6533	0.5
Brugia malayi	hypothetical protein	0.0041	0.0785	0.1025
Schistosoma mansoni	hypothetical protein	0.0059	0.1264	0.0795
Trypanosoma brucei	AMP deaminase, putative	0.0084	0.1918	0.5
Toxoplasma gondii	Adenosine/AMP deaminase domain-containing protein	0.0258	0.6533	1
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0041	0.0785	0.1085
Loa Loa (eye worm)	hypothetical protein	0.0174	0.4303	0.655
Echinococcus multilocularis	geminin	0.0195	0.4852	0.7393
Schistosoma mansoni	adenosine deaminase	0.0258	0.6533	0.6347
Loa Loa (eye worm)	hypothetical protein	0.0174	0.4303	0.655
Plasmodium vivax	adenosine deaminase, putative	0.0258	0.6533	1
Schistosoma mansoni	hypothetical protein	0.0195	0.4852	0.4576
Loa Loa (eye worm)	hypothetical protein	0.0258	0.6533	1
Entamoeba histolytica	AMP deaminase, putative	0.0084	0.1918	0.1972
Onchocerca volvulus		0.0031	0.051	0.0781
Trypanosoma cruzi	adenosine monophosphate deaminase, putative	0.0084	0.1918	0.5
Onchocerca volvulus	Adenosine deaminase homolog	0.0258	0.6533	1
Brugia malayi	Intermediate filament tail domain containing protein	0.0031	0.051	0.0596
Trypanosoma cruzi	AMP deaminase, putative	0.0084	0.1918	0.5
Onchocerca volvulus	AMP deaminase 2 homolog	0.0084	0.1918	0.2936
Echinococcus multilocularis	adenosine deaminase	0.0258	0.6533	1
Plasmodium falciparum	adenosine deaminase	0.0258	0.6533	1
Echinococcus multilocularis	lamin	0.0031	0.051	0.0659
Trypanosoma cruzi	AMP deaminase, putative	0.0084	0.1918	0.5
Schistosoma mansoni	hypothetical protein	0.0041	0.0785	0.0289
Mycobacterium ulcerans	adenosine deaminase	0.0258	0.6533	0.5
Trypanosoma cruzi	AMP deaminase, putative	0.0084	0.1918	0.5
Trypanosoma brucei	AMP deaminase, putative	0.0084	0.1918	0.5
Loa Loa (eye worm)	hypothetical protein	0.0084	0.1918	0.286
Echinococcus multilocularis	AMP deaminase 2	0.0084	0.1918	0.2843
Mycobacterium leprae	Probable adenosine deaminase Add (ADENOSINE AMINOHYDROLASE)	0.0258	0.6533	0.5
Trypanosoma brucei	AMP deaminase, putative	0.0084	0.1918	0.5
Entamoeba histolytica	adenosine deaminase, putative	0.0258	0.6533	1
Brugia malayi	adenosine monophosphate deaminase	0.0084	0.1918	0.2794
Loa Loa (eye worm)	cytoplasmic intermediate filament protein	0.0017	0.0128	0.0091
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0031	0.051	0.0681
Echinococcus granulosus	intermediate filament protein	0.0031	0.051	0.0659
Loa Loa (eye worm)	hypothetical protein	0.0174	0.4303	0.655
Trypanosoma cruzi	AMP deaminase, putative	0.0084	0.1918	0.5
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0085	0.0023
Loa Loa (eye worm)	hypothetical protein	0.0031	0.051	0.0681
Brugia malayi	intermediate filament protein	0.0031	0.051	0.0596
Echinococcus granulosus	AMP deaminase 2	0.0084	0.1918	0.2843
Schistosoma mansoni	adenosine deaminase-related	0.0258	0.6533	0.6347
Schistosoma mansoni	AMP deaminase	0.0084	0.1918	0.1484

Activities

Activity type	Activity value	Assay description	Source	Reference
Ki (binding)	= 3.03 uM	Binding affinity against muscarinic acetylcholine receptor from rat brain crude membrane, using [3H]-OXO-M (oxotremorine) as the radioligand.	ChEMBL.	7739014
Max stimulation (functional)	= 8 %	Maximum stimulation of phosphatidyl inositol in rat hippocampal tissue, activity is expressed as percent of carbachol response	ChEMBL.	7739014
Max stimulation (functional)	= 8 %	Maximum stimulation of phosphatidyl inositol in rat hippocampal tissue, activity is expressed as percent of carbachol response	ChEMBL.	7739014

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

PubChem: 10331287

Bibliographic References

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 56639