TDR Targets

Basic information

Technical information

TDR Targets ID: 714505
Name: ethyl 1-[2-(3-methylphenoxy)ethyl]piperidine- 3-carboxylate
MW: 291.385 | Formula: C17H25NO3
H donors: 0 H acceptors: 1 LogP: 3.01 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: CCOC(=O)C1CCCN(C1)CCOc1cccc(c1)C
InChi: 1S/C17H25NO3/c1-3-20-17(19)15-7-5-9-18(13-15)10-11-21-16-8-4-6-14(2)12-16/h4,6,8,12,15H,3,5,7,9-11,13H2,1-2H3
InChiKey: KYWBWUCZGVWJDG-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

1-[2-(3-methylphenoxy)ethyl]-3-piperidinecarboxylic acid ethyl ester
1-[2-(3-methylphenoxy)ethyl]nipecotic acid ethyl ester

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
Schistosoma mansoni	cathepsin F (C01 family)	0.0125	0.3039	0.6671
Brugia malayi	Cathepsin L-like precursor	0.0125	0.3039	1
Plasmodium vivax	vivapain-2	0.0125	0.3039	1
Onchocerca volvulus	Cathepsin F homolog	0.0125	0.3039	1
Echinococcus multilocularis	cathepsin L	0.0064	0.1038	0.2085
Mycobacterium ulcerans	ATP-dependent Clp protease proteolytic subunit	0.0078	0.1487	1
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0125	0.3039	0.6671
Leishmania major	cathepsin L-like protease	0.0125	0.3039	0.2949
Brugia malayi	Cathepsin L-like precursor	0.0083	0.1675	0.5313
Chlamydia trachomatis	ATP-dependent Clp protease proteolytic subunit	0.0078	0.1487	0.5
Onchocerca volvulus		0.0125	0.3039	1
Brugia malayi	Cathepsin L-like precursor	0.0125	0.3039	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0335	1	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0125	0.3039	1
Loa Loa (eye worm)	cysteine protease	0.0125	0.3039	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0125	0.3039	1
Trypanosoma cruzi	cysteine protease, putative	0.0064	0.1038	0.0922
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0064	0.1038	0.3126
Echinococcus multilocularis	peptidase Clp (S14 family)	0.0051	0.0599	0.1081
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0125	0.3039	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0125	0.3039	1
Mycobacterium leprae	PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2)	0.0078	0.1487	1
Trypanosoma cruzi	cysteine proteinase, putative	0.0064	0.1038	0.0922
Echinococcus granulosus	cathepsin L	0.0064	0.1038	0.2085
Echinococcus multilocularis	cathepsin L cysteine protease	0.0125	0.3039	0.6671
Entamoeba histolytica	cysteine proteinase 2	0.0064	0.1038	0.3126
Loa Loa (eye worm)	hypothetical protein	0.0125	0.3039	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0064	0.1038	0.0922
Entamoeba histolytica	cysteine protease, putative	0.0064	0.1038	0.3126
Trypanosoma cruzi	cysteine peptidase, putative	0.0335	1	1
Entamoeba histolytica	cysteine proteinase 1, putative	0.0064	0.1038	0.3126
Echinococcus multilocularis	geminin	0.0168	0.4492	1
Echinococcus granulosus	cysteine protease	0.0064	0.1038	0.2085
Schistosoma mansoni	cathepsin F (C01 family)	0.0083	0.1675	0.3544
Loa Loa (eye worm)	hypothetical protein	0.0083	0.1675	0.5313
Entamoeba histolytica	cysteine protease, putative	0.0064	0.1038	0.3126
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0125	0.3039	1
Onchocerca volvulus		0.0125	0.3039	1
Entamoeba histolytica	cysteine protease, putative	0.0064	0.1038	0.3126
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0041	0.0276	0.0509
Leishmania major	cysteine peptidase A (CPA)	0.0125	0.3039	0.2949
Onchocerca volvulus	Cathepsin L homolog	0.0125	0.3039	1
Mycobacterium ulcerans	ATP-dependent Clp protease proteolytic subunit	0.0078	0.1487	1
Entamoeba histolytica	cysteine protease, putative	0.0125	0.3039	1
Schistosoma mansoni	cathepsin F (C01 family)	0.0125	0.3039	0.6671
Brugia malayi	Cathepsin L-like precursor	0.0041	0.0276	0.0509
Echinococcus granulosus	cathepsin L cysteine protease	0.0064	0.1038	0.2085
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0276	0.0509
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0125	0.3039	1
Brugia malayi	Papain family cysteine protease containing protein	0.0125	0.3039	1
Loa Loa (eye worm)	hypothetical protein	0.0078	0.1487	0.4668
Entamoeba histolytica	cysteine protease, putative	0.0064	0.1038	0.3126
Brugia malayi	Cathepsin L-like precursor	0.0125	0.3039	1
Entamoeba histolytica	cysteine protease, putative	0.0064	0.1038	0.3126
Trypanosoma cruzi	cysteine peptidase, putative	0.0335	1	1
Leishmania major	cathepsin L-like protease	0.0125	0.3039	0.2949
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0125	0.3039	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0125	0.3039	1
Entamoeba histolytica	cysteine proteinase, putative	0.0125	0.3039	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0125	0.3039	1
Onchocerca volvulus		0.0125	0.3039	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0335	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0335	1	1
Brugia malayi	Cathepsin L-like precursor	0.0125	0.3039	1
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0064	0.1038	0.2085
Loa Loa (eye worm)	hypothetical protein	0.0083	0.1675	0.5313
Toxoplasma gondii	ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein	0.0078	0.1487	0.4668
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0125	0.3039	1
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0083	0.1675	0.5313
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0125	0.3039	1
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.0064	0.1038	0.0922
Brugia malayi	Cathepsin L-like precursor	0.0125	0.3039	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0125	0.3039	1
Toxoplasma gondii	ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein	0.0078	0.1487	0.4668
Echinococcus granulosus	ATP dependent Clp protease proteolytic subunit	0.0078	0.1487	0.3114
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0083	0.1675	0.5313
Mycobacterium leprae	PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP)	0.0051	0.0599	0.4031
Plasmodium vivax	vivapain-1	0.0064	0.1038	0.2757
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0125	0.3039	0.6671
Entamoeba histolytica	cysteine protease, putative	0.0064	0.1038	0.3126
Schistosoma mansoni	hypothetical protein	0.0168	0.4492	1
Entamoeba histolytica	cysteine protease, putative	0.0064	0.1038	0.3126
Brugia malayi	cathepsin L-like cysteine proteinase, identical	0.0041	0.0276	0.0509
Leishmania major	cathepsin L-like protease	0.0335	1	1
Treponema pallidum	ATP-dependent Clp protease proteolytic subunit	0.0078	0.1487	0.5
Entamoeba histolytica	cysteine protease, putative	0.0064	0.1038	0.3126
Brugia malayi	Cathepsin L-like precursor	0.0083	0.1675	0.5313
Onchocerca volvulus		0.0125	0.3039	1
Leishmania major	cathepsin L-like protease	0.0335	1	1
Plasmodium vivax	vivapain-2	0.0125	0.3039	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0125	0.3039	1
Entamoeba histolytica	cysteine protease, putative	0.0064	0.1038	0.3126
Schistosoma mansoni	cathepsin s	0.0041	0.0276	0.034
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0125	0.3039	0.6671
Trypanosoma cruzi	cysteine peptidase, putative	0.0064	0.1038	0.0922
Entamoeba histolytica	cysteine proteinase, putative	0.0064	0.1038	0.3126
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0335	1	1
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0276	0.0509
Brugia malayi	Probable ClpP-like protease	0.0078	0.1487	0.4668
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0125	0.3039	1
Echinococcus granulosus	peptidase Clp S14 family	0.0051	0.0599	0.1081
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0125	0.3039	1
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0125	0.3039	1
Brugia malayi	Papain family cysteine protease containing protein	0.0064	0.1038	0.3126
Echinococcus multilocularis	cathepsin L cysteine protease	0.0125	0.3039	0.6671
Trypanosoma cruzi	cysteine proteinase, putative	0.0064	0.1038	0.0922
Loa Loa (eye worm)	ctsf protein	0.0125	0.3039	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0125	0.3039	1
Echinococcus multilocularis	ATP dependent Clp protease proteolytic subunit	0.0078	0.1487	0.3114
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0125	0.3039	1
Entamoeba histolytica	cysteine proteinase, putative	0.0064	0.1038	0.3126
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0335	1	1
Schistosoma mansoni	hypothetical protein	0.0168	0.4492	1
Schistosoma mansoni	peptidase Clp (S14 family)	0.0078	0.1487	0.3114
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0335	1	1
Trypanosoma cruzi	major cysteine proteinase, putative	0.0233	0.6633	0.659
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0083	0.1675	0.5313
Plasmodium vivax	ATP-dependent Clp protease proteolytic subunit, putative	0.0078	0.1487	0.4382
Mycobacterium tuberculosis	Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2)	0.0051	0.0599	1
Chlamydia trachomatis	ATP-dependent Clp protease proteolytic subunit	0.0078	0.1487	0.5
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0335	1	1
Echinococcus granulosus	cathepsin l1	0.0125	0.3039	0.6671
Entamoeba histolytica	cysteine proteinase, putative	0.0125	0.3039	1
Leishmania major	cathepsin L-like protease	0.0125	0.3039	0.2949
Echinococcus multilocularis	cysteine protease	0.0125	0.3039	0.6671
Brugia malayi	cathepsin L-like precursor	0.0083	0.1675	0.5313
Loa Loa (eye worm)	fibroinase	0.0125	0.3039	1
Toxoplasma gondii	cathepsin CPL	0.0125	0.3039	1
Entamoeba histolytica	cysteine proteinase, putative	0.0064	0.1038	0.3126
Leishmania major	cathepsin L-like protease	0.0125	0.3039	0.2949
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0125	0.3039	1
Echinococcus granulosus	geminin	0.0168	0.4492	1
Brugia malayi	Cathepsin L-like precursor	0.0125	0.3039	1
Entamoeba histolytica	cysteine protease, putative	0.0064	0.1038	0.3126
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0335	1	1
Entamoeba histolytica	cysteine protease, putative	0.0064	0.1038	0.3126
Brugia malayi	Papain family cysteine protease containing protein	0.0064	0.1038	0.3126
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0125	0.3039	1
Plasmodium vivax	unspecified product	0.0064	0.1038	0.2757
Trypanosoma cruzi	cysteine peptidase, putative	0.0335	1	1
Onchocerca volvulus		0.0125	0.3039	1
Entamoeba histolytica	cysteine protease, putative	0.0064	0.1038	0.3126
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0125	0.3039	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0041	0.0276	0.015
Wolbachia endosymbiont of Brugia malayi	ATP-dependent Clp protease proteolytic subunit	0.0078	0.1487	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0125	0.3039	0.2949
Entamoeba histolytica	cysteine proteinase, putative	0.0083	0.1675	0.5313
Loa Loa (eye worm)	hypothetical protein	0.0083	0.1675	0.5313
Onchocerca volvulus		0.0125	0.3039	1
Plasmodium vivax	vivapain-3	0.0064	0.1038	0.2757
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0335	1	1
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0276	0.0509
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0293	0.8635	0.8618
Trypanosoma cruzi	cruzipain precursor, putative	0.0041	0.0276	0.015
Echinococcus multilocularis	cysteine protease	0.0125	0.3039	0.6671
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0125	0.3039	1
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0125	0.3039	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0125	0.3039	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0125	0.3039	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0064	0.1038	0.3126
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0064	0.1038	0.2085
Onchocerca volvulus	Cathepsin L homolog	0.0125	0.3039	1
Trypanosoma cruzi	cruzipain precursor, putative	0.0335	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0125	0.3039	1
Entamoeba histolytica	cysteine proteinase, putative	0.0064	0.1038	0.3126
Entamoeba histolytica	cysteine protease, putative	0.0064	0.1038	0.3126
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0064	0.1038	0.2085
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0125	0.3039	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0064	0.1038	0.0922
Leishmania major	cathepsin L-like protease	0.0125	0.3039	0.2949
Plasmodium falciparum	ATP-dependent Clp protease proteolytic subunit	0.0078	0.1487	0.2244
Onchocerca volvulus		0.0125	0.3039	1
Mycobacterium tuberculosis	Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP)	0.0051	0.0599	1
Echinococcus granulosus	cathepsin l1	0.0083	0.1675	0.3544
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0335	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0125	0.3039	1
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0125	0.3039	0.6671
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0335	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0125	0.3039	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0125	0.3039	1
Brugia malayi	cathepsin F-like cysteine proteinase	0.0041	0.0276	0.0509

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

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Bibliographic References

No literature references available for this target.

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Detailed information for compound 714505