TDR Targets

Basic information

Technical information

TDR Targets ID: 1899798
Name: (Z)-(2-nitrophenoxy)-(1,2,5-trimethyl-4-piper idylidene)amine
MW: 277.319 | Formula: C14H19N3O3
H donors: 0 H acceptors: 2 LogP: 2.69 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: CN1CC(C)/C(=N\Oc2ccccc2[N+](=O)[O-])/CC1C
InChi: 1S/C14H19N3O3/c1-10-9-16(3)11(2)8-12(10)15-20-14-7-5-4-6-13(14)17(18)19/h4-7,10-11H,8-9H2,1-3H3/b15-12-
InChiKey: UQBBTDSGUQJIBT-QINSGFPZSA-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

1,2,5-Trimethyl-piperidin-4-one O-(2-nitro-phenyl)-oxime
BAS 01062731

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
Loa Loa (eye worm)	hypothetical protein	0.8258	1	1
Trypanosoma brucei	cysteine peptidase C (CPC)	0.3158	0.3093	0.6644
Brugia malayi	Cathepsin L-like precursor	0.3727	0.3864	0.3864
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.3727	0.3864	1
Toxoplasma gondii	cathepsin CPL	0.3727	0.3864	1
Echinococcus granulosus	cathepsin L cysteine proteinase	0.3727	0.3864	0.3864
Entamoeba histolytica	cysteine protease, putative	0.2031	0.1566	0.4054
Loa Loa (eye worm)	ctsf protein	0.3727	0.3864	0.3864
Entamoeba histolytica	cysteine protease, putative	0.2031	0.1566	0.4054
Trypanosoma cruzi	cysteine peptidase, putative	0.3727	0.3864	0.3864
Leishmania major	cathepsin L-like protease	0.3727	0.3864	1
Onchocerca volvulus	Cathepsin L homolog	0.3727	0.3864	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.3727	0.3864	1
Echinococcus multilocularis	cathepsin L cysteine protease	0.3727	0.3864	0.3864
Plasmodium vivax	vivapain-3	0.2031	0.1566	0.4054
Toxoplasma gondii	cathepsin B	0.3158	0.3093	0.8004
Plasmodium vivax	unspecified product	0.2031	0.1566	0.4054
Leishmania major	cysteine peptidase A (CPA)	0.3727	0.3864	1
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.3158	0.3093	0.3093
Onchocerca volvulus		0.3727	0.3864	1
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.8258	1	1
Trypanosoma cruzi	cysteine peptidase, putative	0.1157	0.0383	0.0383
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.3727	0.3864	1
Entamoeba histolytica	cysteine proteinase 2	0.2031	0.1566	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.3727	0.3864	1
Trypanosoma cruzi	cysteine proteinase, putative	0.2031	0.1566	0.1566
Echinococcus granulosus	cathepsin b	0.8258	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.3727	0.3864	1
Echinococcus multilocularis	cathepsin L	0.2031	0.1566	0.1566
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.8258	1	1
Trypanosoma cruzi	cruzipain precursor, putative	0.1157	0.0383	0.0383
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.8258	1	1
Entamoeba histolytica	cysteine proteinase, putative	0.2031	0.1566	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.3727	0.3864	1
Entamoeba histolytica	cysteine proteinase 1, putative	0.2031	0.1566	0.4054
Loa Loa (eye worm)	cysteine protease	0.3727	0.3864	0.3864
Echinococcus granulosus	cysteine protease	0.2031	0.1566	0.1566
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.3727	0.3864	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.3727	0.3864	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.257	0.2297	0.5946
Brugia malayi	Cathepsin L-like precursor	0.3727	0.3864	0.3864
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.3727	0.3864	1
Brugia malayi	Papain family cysteine protease containing protein	0.3727	0.3864	0.3864
Trypanosoma cruzi	cysteine peptidase, putative	0.3727	0.3864	0.3864
Onchocerca volvulus		0.3727	0.3864	1
Plasmodium falciparum	cysteine proteinase falcipain 3	0.3727	0.3864	1
Brugia malayi	cathepsin F-like cysteine proteinase	0.1157	0.0383	0.0383
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.3727	0.3864	1
Plasmodium vivax	vivapain-1	0.2031	0.1566	0.4054
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.8258	1	1
Trypanosoma cruzi	cysteine peptidase, putative	0.2031	0.1566	0.1566
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.3727	0.3864	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.3727	0.3864	1
Trypanosoma cruzi	cysteine protease, putative	0.2031	0.1566	0.1566
Entamoeba histolytica	cysteine protease, putative	0.2031	0.1566	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.3727	0.3864	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.3727	0.3864	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.3727	0.3864	0.3864
Entamoeba histolytica	cysteine protease, putative	0.2031	0.1566	0.4054
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.3727	0.3864	0.3864
Brugia malayi	Papain family cysteine protease containing protein	0.2031	0.1566	0.1566
Loa Loa (eye worm)	hypothetical protein	0.3727	0.3864	0.3864
Loa Loa (eye worm)	cathepsin B	0.3158	0.3093	0.3093
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.3727	0.3864	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.3727	0.3864	1
Brugia malayi	Cathepsin L-like precursor	0.257	0.2297	0.2297
Loa Loa (eye worm)	hypothetical protein	0.257	0.2297	0.2297
Schistosoma mansoni	cathepsin F (C01 family)	0.3727	0.3864	0.3864
Brugia malayi	Cathepsin L-like precursor	0.3727	0.3864	0.3864
Loa Loa (eye worm)	hypothetical protein	0.257	0.2297	0.2297
Entamoeba histolytica	cysteine protease, putative	0.2031	0.1566	0.4054
Leishmania major	cathepsin L-like protease	0.3727	0.3864	1
Plasmodium falciparum	cysteine proteinase falcipain 1	0.2031	0.1566	0.4054
Giardia lamblia	Cathepsin B precursor	0.3158	0.3093	1
Entamoeba histolytica	cysteine protease, putative	0.2031	0.1566	0.4054
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.3727	0.3864	1
Leishmania major	cathepsin L-like protease	0.3727	0.3864	1
Giardia lamblia	Cathepsin B precursor	0.3158	0.3093	1
Brugia malayi	cathepsin L-like cysteine proteinase, identical	0.1157	0.0383	0.0383
Trypanosoma cruzi	cruzipain precursor, putative	0.3727	0.3864	0.3864
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.3727	0.3864	1
Loa Loa (eye worm)	hypothetical protein	0.1157	0.0383	0.0383
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.3727	0.3864	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.3727	0.3864	1
Onchocerca volvulus		0.257	0.2297	0.5946
Entamoeba histolytica	cysteine proteinase, putative	0.2031	0.1566	0.4054
Loa Loa (eye worm)	hypothetical protein	0.1157	0.0383	0.0383
Loa Loa (eye worm)	hypothetical protein	0.1157	0.0383	0.0383
Entamoeba histolytica	cysteine protease, putative	0.2031	0.1566	0.4054
Onchocerca volvulus	Cathepsin L homolog	0.3727	0.3864	1
Onchocerca volvulus	Cathepsin F homolog	0.3727	0.3864	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.2031	0.1566	0.4054
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.2031	0.1566	0.1566
Echinococcus granulosus	cathepsin l cysteine peptidase	0.3727	0.3864	0.3864
Schistosoma mansoni	cathepsin s	0.1157	0.0383	0.0383
Leishmania major	cathepsin L-like protease	0.3727	0.3864	1
Brugia malayi	Cathepsin L-like precursor	0.3727	0.3864	0.3864
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.3727	0.3864	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.3158	0.3093	0.8004
Schistosoma mansoni	cathepsin F (C01 family)	0.257	0.2297	0.2297
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.3727	0.3864	1
Brugia malayi	Cathepsin L-like precursor	0.3727	0.3864	0.3864
Entamoeba histolytica	cysteine proteinase, putative	0.2031	0.1566	0.4054
Entamoeba histolytica	cysteine protease, putative	0.2031	0.1566	0.4054
Entamoeba histolytica	cysteine protease, putative	0.2031	0.1566	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.3727	0.3864	1
Echinococcus granulosus	cathepsin L cysteine protease	0.2031	0.1566	0.1566
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.3727	0.3864	1
Onchocerca volvulus		0.3727	0.3864	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.3727	0.3864	1
Giardia lamblia	Cathepsin B precursor	0.3158	0.3093	1
Entamoeba histolytica	cysteine protease, putative	0.2031	0.1566	0.4054
Entamoeba histolytica	cysteine protease, putative	0.2031	0.1566	0.4054
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.3727	0.3864	1
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.2031	0.1566	0.1566
Onchocerca volvulus		0.3727	0.3864	1
Echinococcus granulosus	cathepsin l1	0.3727	0.3864	0.3864
Brugia malayi	Papain family cysteine protease containing protein	0.2031	0.1566	0.1566
Echinococcus multilocularis	cathepsin L cysteine protease	0.3727	0.3864	0.3864
Loa Loa (eye worm)	hypothetical protein	0.257	0.2297	0.2297
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.2031	0.1566	0.1566
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.8258	1	1
Echinococcus granulosus	cathepsin b	0.8258	1	1
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.2031	0.1566	0.1566
Schistosoma mansoni	cathepsin F (C01 family)	0.3727	0.3864	0.3864
Echinococcus multilocularis	cathepsin b	0.8258	1	1
Brugia malayi	Cathepsin L-like precursor	0.3727	0.3864	0.3864
Echinococcus multilocularis	cathepsin b	0.8258	1	1
Echinococcus granulosus	cathepsin L	0.2031	0.1566	0.1566
Trypanosoma cruzi	cysteine peptidase, putative	0.3727	0.3864	0.3864
Brugia malayi	Cathepsin L-like cysteine proteinase	0.257	0.2297	0.2297
Plasmodium vivax	unspecified product	0.1157	0.0383	0.0991
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.3727	0.3864	1
Entamoeba histolytica	cysteine proteinase, putative	0.2031	0.1566	0.4054
Brugia malayi	cathepsin L-like precursor	0.257	0.2297	0.2297
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.1157	0.0383	0.0383
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.3727	0.3864	1
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.257	0.2297	0.2297
Echinococcus multilocularis	cysteine protease	0.3727	0.3864	0.3864
Leishmania major	cathepsin L-like protease	0.3727	0.3864	1
Loa Loa (eye worm)	fibroinase	0.3727	0.3864	0.3864
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.3158	0.3093	0.3093
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.3727	0.3864	1
Onchocerca volvulus		0.3727	0.3864	1
Entamoeba histolytica	cysteine proteinase, putative	0.3727	0.3864	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.3727	0.3864	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.3727	0.3864	1
Plasmodium vivax	vivapain-2	0.3727	0.3864	1
Entamoeba histolytica	cysteine protease, putative	0.2031	0.1566	0.4054
Brugia malayi	Cathepsin L-like precursor	0.1157	0.0383	0.0383
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.2031	0.1566	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.257	0.2297	0.5946
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.3727	0.3864	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.3727	0.3864	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.3727	0.3864	1
Echinococcus multilocularis	cysteine protease	0.3727	0.3864	0.3864
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.3727	0.3864	1
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.3727	0.3864	0.3864
Trypanosoma cruzi	cysteine proteinase, putative	0.2031	0.1566	0.1566
Onchocerca volvulus		0.3727	0.3864	1
Leishmania major	cathepsin L-like protease	0.3727	0.3864	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.3727	0.3864	1
Plasmodium vivax	vivapain-2	0.3727	0.3864	1
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.3727	0.3864	0.3864
Entamoeba histolytica	cysteine protease, putative	0.2031	0.1566	0.4054
Leishmania major	cathepsin L-like protease	0.3727	0.3864	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.3727	0.3864	1
Entamoeba histolytica	cysteine proteinase, putative	0.257	0.2297	0.5946
Echinococcus granulosus	cathepsin l1	0.257	0.2297	0.2297
Entamoeba histolytica	cysteine protease, putative	0.3727	0.3864	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.3727	0.3864	1
Trypanosoma cruzi	cysteine peptidase, putative	0.3727	0.3864	0.3864
Brugia malayi	Cathepsin L-like precursor	0.257	0.2297	0.2297
Leishmania major	cathepsin L-like protease	0.3727	0.3864	1
Onchocerca volvulus		0.3727	0.3864	1
Entamoeba histolytica	cysteine proteinase, putative	0.3727	0.3864	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

ChEMBL: CHEMBL3303528

Bibliographic References

No literature references available for this target.

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

Detailed information for compound 1899798