TDR Targets

Basic information

Technical information

TDR Targets ID: 660977
Name: 3-methyl-1-[2-(4-propoxyphenoxy)ethyl]piperid ine
MW: 277.402 | Formula: C17H27NO2
H donors: 0 H acceptors: 0 LogP: 4.08 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: CCCOc1ccc(cc1)OCCN1CCCC(C1)C
InChi: 1S/C17H27NO2/c1-3-12-19-16-6-8-17(9-7-16)20-13-11-18-10-4-5-15(2)14-18/h6-9,15H,3-5,10-14H2,1-2H3
InChiKey: TXXWLOZCYUANIW-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

No synonyms found for this compound

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
Brugia malayi	hypothetical protein	0.0236	0.17	0.1594
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0221	0.1579	1
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0142	0.0095
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.1305	1	1
Onchocerca volvulus		0.0221	0.1579	1
Brugia malayi	hypothetical protein	0.0221	0.1579	0.1472
Brugia malayi	Carboxylesterase family protein	0.0221	0.1579	0.1472
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0033	0.0127	0.0007
Mycobacterium ulcerans	acyl-CoA synthetase	0.0047	0.0235	0.075
Echinococcus multilocularis	pyruvate kinase	0.0026	0.0071	0.0071
Trypanosoma cruzi	pyruvate kinase 2, putative	0.0033	0.0126	0.5
Onchocerca volvulus		0.0221	0.1579	1
Loa Loa (eye worm)	hypothetical protein	0.0221	0.1579	0.1539
Brugia malayi	Carboxylesterase family protein	0.1305	1	1
Echinococcus granulosus	acetylcholinesterase	0.1305	1	1
Loa Loa (eye worm)	carboxylesterase	0.0221	0.1579	0.1539
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0235	0.0188
Brugia malayi	Carboxylesterase family protein	0.0221	0.1579	0.1472
Echinococcus multilocularis	neuroligin	0.0221	0.1579	0.1579
Mycobacterium ulcerans	hypothetical protein	0.0047	0.0235	0.075
Echinococcus granulosus	acetylcholinesterase	0.1305	1	1
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0142	0.0095
Leishmania major	4-coumarate:coa ligase-like protein	0.0047	0.0235	1
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0142	0.0095
Schistosoma mansoni	hypothetical protein	0.0048	0.0241	0.0241
Echinococcus granulosus	survival motor neuron protein 1	0.0236	0.17	0.17
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0048	0.0241	0.0117
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0035	0.0142	0.011
Echinococcus granulosus	BC026374 protein S09 family	0.0221	0.1579	0.1579
Trichomonas vaginalis	spcc417.12 protein, putative	0.0221	0.1579	1
Onchocerca volvulus		0.0047	0.0235	0.075
Schistosoma mansoni	pyruvate kinase	0.0033	0.0126	0.0126
Brugia malayi	AMP-binding enzyme family protein	0.0047	0.0235	0.011
Trichomonas vaginalis	carboxylesterase domain containing protein, putative	0.0221	0.1579	1
Trypanosoma cruzi	pyruvate kinase 2, putative	0.0033	0.0126	0.5
Loa Loa (eye worm)	hypothetical protein	0.0221	0.1579	0.1539
Echinococcus granulosus	pyruvate kinase	0.0033	0.0126	0.0126
Brugia malayi	AMP-binding enzyme family protein	0.0047	0.0235	0.011
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0047	0.0235	1
Schistosoma mansoni	BC026374 protein (S09 family)	0.0221	0.1579	0.1579
Echinococcus multilocularis	survival motor neuron protein 1	0.0236	0.17	0.17
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0047	0.0235	0.075
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0047	0.0235	0.075
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0047	0.0235	0.075
Leishmania major	4-coumarate:coa ligase-like protein	0.0047	0.0235	1
Toxoplasma gondii	pyruvate kinase PyK1	0.0033	0.0126	1
Echinococcus multilocularis	pyruvate kinase	0.0033	0.0126	0.0126
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0221	0.1579	0.1579
Echinococcus multilocularis	carboxylesterase 5A	0.1305	1	1
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0221	0.1579	0.1579
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0033	0.0127	0.0007
Loa Loa (eye worm)	acetylcholinesterase 1	0.1305	1	1
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0047	0.0235	0.075
Loa Loa (eye worm)	hypothetical protein	0.0221	0.1579	0.1539
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0033	0.0127	0.0007
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0047	0.0235	1
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0047	0.0235	1
Brugia malayi	Carboxylesterase family protein	0.0221	0.1579	0.1472
Echinococcus granulosus	para nitrobenzyl esterase	0.0221	0.1579	0.1579
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0033	0.0127	0.0007
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0047	0.0235	0.075
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0221	0.1579	0.1579
Onchocerca volvulus		0.0221	0.1579	1
Loa Loa (eye worm)	carboxylesterase	0.0221	0.1579	0.1539
Loa Loa (eye worm)	pyruvate kinase	0.0033	0.0126	0.0079
Loa Loa (eye worm)	hypothetical protein	0.0236	0.17	0.166
Loa Loa (eye worm)	hypothetical protein	0.0221	0.1579	0.1539
Plasmodium vivax	pyruvate kinase, putative	0.0033	0.0126	0.8869
Mycobacterium ulcerans	acyl-CoA synthetase	0.0047	0.0235	0.075
Echinococcus granulosus	family S9 non peptidase ue S09 family	0.0221	0.1579	0.1579
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0142	0.0095
Plasmodium falciparum	acyl-CoA synthetase	0.0035	0.0142	1
Loa Loa (eye worm)	pyruvate kinase	0.0033	0.0126	0.0079
Loa Loa (eye worm)	pyruvate kinase	0.0033	0.0126	0.0079
Echinococcus granulosus	pyruvate kinase	0.0033	0.0126	0.0126
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0035	0.0142	0.011
Plasmodium vivax	acyl-CoA synthetase, putative	0.0035	0.0142	1
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0126	0.0079
Echinococcus multilocularis	BC026374 protein (S09 family)	0.0221	0.1579	0.1579
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0221	0.1579	1
Loa Loa (eye worm)	hypothetical protein	0.0221	0.1579	0.1539
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0235	0.0188
Loa Loa (eye worm)	carboxylesterase	0.1305	1	1
Loa Loa (eye worm)	hypothetical protein	0.1305	1	1
Schistosoma mansoni	survival motor neuron protein	0.0048	0.0241	0.0241
Mycobacterium ulcerans	carboxylesterase, LipT	0.0221	0.1579	1
Echinococcus multilocularis	acetylcholinesterase	0.1305	1	1
Loa Loa (eye worm)	hypothetical protein	0.0221	0.1579	0.1539
Onchocerca volvulus		0.0221	0.1579	1
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0047	0.0235	0.075
Trypanosoma brucei	pyruvate kinase 1	0.0033	0.0126	0.5
Trypanosoma brucei	pyruvate kinase 1, putative	0.0033	0.0126	0.5
Echinococcus multilocularis	acetylcholinesterase	0.1305	1	1
Echinococcus multilocularis	family S9 non peptidase ue (S09 family)	0.0221	0.1579	0.1579
Onchocerca volvulus		0.0221	0.1579	1
Schistosoma mansoni	neuroligin 3 (S09 family)	0.0221	0.1579	0.1579
Schistosoma mansoni	acetylcholinesterase	0.0221	0.1579	0.1579
Brugia malayi	Carboxylesterase family protein	0.0221	0.1579	0.1472
Echinococcus multilocularis	pyruvate kinase	0.0033	0.0126	0.0126
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0047	0.0235	1
Mycobacterium tuberculosis	Carboxylesterase LipT	0.0221	0.1579	1
Schistosoma mansoni	pyruvate kinase	0.0033	0.0126	0.0126
Echinococcus multilocularis	para nitrobenzyl esterase	0.0221	0.1579	0.1579
Onchocerca volvulus		0.0048	0.0241	0.0793
Chlamydia trachomatis	acylglycerophosphoethanolamine acyltransferase	0.0035	0.0142	1
Echinococcus granulosus	carboxylesterase 5A	0.1305	1	1
Brugia malayi	AMP-binding enzyme family protein	0.0047	0.0235	0.011
Giardia lamblia	Pyruvate kinase	0.0033	0.0126	1
Loa Loa (eye worm)	hypothetical protein	0.0221	0.1579	0.1539
Plasmodium falciparum	pyruvate kinase	0.0033	0.0126	0.8869
Leishmania major	4-coumarate:coa ligase-like protein	0.0047	0.0235	1
Mycobacterium ulcerans	acyl-CoA synthetase	0.0047	0.0235	0.075
Entamoeba histolytica	acyl-coA synthetase, putative	0.0047	0.0235	1
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0235	0.0188
Schistosoma mansoni	gliotactin	0.0221	0.1579	0.1579
Echinococcus granulosus	neuroligin	0.0221	0.1579	0.1579
Loa Loa (eye worm)	hypothetical protein	0.1305	1	1
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0142	0.0095

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 660977