TDR Targets

Basic information

Technical information

TDR Targets ID: 901534
Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-p ropylpiperazin-1-yl)acetamide
MW: 363.806 | Formula: C16H21ClF3N3O
H donors: 1 H acceptors: 1 LogP: 3.38 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: CCCN1CCN(CC1)CC(=O)Nc1cc(ccc1Cl)C(F)(F)F
InChi: 1S/C16H21ClF3N3O/c1-2-5-22-6-8-23(9-7-22)11-15(24)21-14-10-12(16(18,19)20)3-4-13(14)17/h3-4,10H,2,5-9,11H2,1H3,(H,21,24)
InChiKey: NWMZLNFMLUTQSO-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-chloro-5-(trifluoromethyl)phenyl]-2-(4-propyl-1-piperazinyl)acetamide
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-propylpiperazin-1-yl)ethanamide
IVK/0022260

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	Nuclear hormone receptor family member nhr-25	0.0186	1	1
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0186	1	1
Loa Loa (eye worm)	hypothetical protein	0.0088	0.3455	0.3455
Brugia malayi	conserved hypotetical protein	0.0088	0.3455	0.3209
Echinococcus granulosus	thyroid hormone receptor alpha	0.0088	0.3455	0.3209
Brugia malayi	photoreceptor-specific nuclear receptor	0.0186	1	1
Schistosoma mansoni	thyroid hormone receptor	0.0186	1	1
Loa Loa (eye worm)	hypothetical protein	0.0088	0.3455	0.3455
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0088	0.3455	0.3209
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0088	0.3455	0.3209
Brugia malayi	Cytochrome P450 family protein	0.0127	0.6077	0.5929
Loa Loa (eye worm)	cytochrome P450 family protein	0.0127	0.6077	0.6077
Loa Loa (eye worm)	hypothetical protein	0.0186	1	1
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0186	1	1
Brugia malayi	Nuclear hormone receptor-like 1	0.0098	0.4156	0.3936
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0098	0.4156	0.3772
Schistosoma mansoni	zinc finger protein	0.0088	0.3455	0.3026
Brugia malayi	nuclear receptor RXR	0.0098	0.4156	0.3936
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0186	1	1
Schistosoma mansoni	nuclear hormone receptor	0.0186	1	1
Loa Loa (eye worm)	hypothetical protein	0.0098	0.4156	0.4156
Loa Loa (eye worm)	hypothetical protein	0.0088	0.3455	0.3455
Loa Loa (eye worm)	hypothetical protein	0.0088	0.3455	0.3455
Brugia malayi	Nuclear hormone receptor E75	0.0088	0.3455	0.3209
Loa Loa (eye worm)	nuclear hormone receptor	0.0088	0.3455	0.3455
Brugia malayi	nuclear hormone receptor	0.0186	1	1
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0186	1	1
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0186	1	1
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0186	1	1
Brugia malayi	ecdysone receptor	0.0088	0.3455	0.3209
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0186	1	1
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0186	1	1
Loa Loa (eye worm)	hypothetical protein	0.0098	0.4156	0.4156
Onchocerca volvulus	Bile acid receptor homolog	0.0186	1	1
Echinococcus granulosus	nuclear receptor subfamily 4 group A	0.0088	0.3455	0.3209
Brugia malayi	nuclear receptor RXR	0.0088	0.3455	0.3209
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0186	1	1
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0186	1	1
Echinococcus multilocularis	nuclear receptor subfamily 4 group A	0.0088	0.3455	0.3209
Schistosoma mansoni	coup transcription factor	0.0186	1	1
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0186	1	1
Loa Loa (eye worm)	hypothetical protein	0.0186	1	1
Brugia malayi	nuclear receptor NHR-88	0.0088	0.3455	0.3209
Echinococcus granulosus	FTZ F1 alpha	0.0186	1	1
Schistosoma mansoni	nuclear hormone receptor	0.0088	0.3455	0.3026
Schistosoma mansoni	nuclear receptor	0.0088	0.3455	0.3026
Brugia malayi	Nuclear hormone receptor-like 1	0.0186	1	1
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0039	0.0182	0.5
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0186	1	1
Brugia malayi	hypothetical protein	0.0088	0.3455	0.3209
Loa Loa (eye worm)	nuclear receptor nhr-7B	0.0088	0.3455	0.3455
Loa Loa (eye worm)	DR-78	0.0088	0.3455	0.3455
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0186	1	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0186	1	1
Loa Loa (eye worm)	hypothetical protein	0.0186	1	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0186	1	1
Loa Loa (eye worm)	steroid hormone receptor	0.0186	1	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0186	1	1
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0098	0.4156	0.3936
Schistosoma mansoni	nuclear receptor nhr-48	0.0088	0.3455	0.3026
Schistosoma mansoni	nuclear hormone receptor	0.0088	0.3455	0.3026
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0186	1	1
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0186	1	1
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0186	1	1
Loa Loa (eye worm)	hypothetical protein	0.0098	0.4156	0.4156
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0088	0.3455	0.3209
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0186	1	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0186	1	1
Loa Loa (eye worm)	hypothetical protein	0.0088	0.3455	0.3455
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0098	0.4156	0.3772
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0088	0.3455	0.3209
Brugia malayi	nuclear receptor NHR-67	0.0088	0.3455	0.3209
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0186	1	1
Brugia malayi	tailless protein	0.0088	0.3455	0.3209
Schistosoma mansoni	RAR-like nuclear receptor	0.0186	1	1
Loa Loa (eye worm)	hypothetical protein	0.0098	0.4156	0.4156
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0186	1	1
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0186	1	1
Loa Loa (eye worm)	hypothetical protein	0.0088	0.3455	0.3455
Brugia malayi	nuclear hormone receptor family member nhr-6	0.0088	0.3455	0.3209
Loa Loa (eye worm)	hypothetical protein	0.0186	1	1
Loa Loa (eye worm)	hypothetical protein	0.0088	0.3455	0.3455
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.0088	0.3455	0.3026
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0186	1	1
Echinococcus granulosus	nuclear receptor nhr 48	0.0088	0.3455	0.3209
Schistosoma mansoni	retinoic acid receptor RXR	0.0186	1	1
Brugia malayi	steroid hormone receptor	0.0186	1	1
Loa Loa (eye worm)	hypothetical protein	0.0088	0.3455	0.3455
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0186	1	1
Brugia malayi	hypothetical protein	0.0088	0.3455	0.3209
Brugia malayi	Nuclear hormone receptor-like 1	0.0098	0.4156	0.3936
Brugia malayi	Steroid receptor seven-up type 2	0.0186	1	1
Brugia malayi	orphan nuclear receptor NR2E1	0.0088	0.3455	0.3209
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0186	1	1
Brugia malayi	nuclear hormone receptor	0.0088	0.3455	0.3209
Schistosoma mansoni	thyroid hormone receptor	0.0186	1	1
Echinococcus multilocularis	ecdysone induced protein 78C	0.0186	1	1
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0186	1	1
Brugia malayi	nuclear hormone receptor family member odr-7	0.0088	0.3455	0.3209
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.0088	0.3455	0.3209
Loa Loa (eye worm)	hypothetical protein	0.0088	0.3455	0.3455
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.0088	0.3455	0.3209
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0186	1	1
Echinococcus granulosus	ecdysone induced protein 78C	0.0186	1	1
Loa Loa (eye worm)	hypothetical protein	0.0088	0.3455	0.3455
Brugia malayi	hypothetical protein	0.0098	0.4156	0.3936
Echinococcus multilocularis	nuclear receptor nhr 48	0.0088	0.3455	0.3209
Loa Loa (eye worm)	hypothetical protein	0.0186	1	1
Loa Loa (eye worm)	hypothetical protein	0.0088	0.3455	0.3455
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0186	1	1
Brugia malayi	nuclear receptor NHR-88	0.0186	1	1
Schistosoma mansoni	nuclear receptor	0.0088	0.3455	0.3026
Onchocerca volvulus		0.0186	1	1
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0186	1	1
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0088	0.3455	0.3209
Loa Loa (eye worm)	hypothetical protein	0.0098	0.4156	0.4156
Brugia malayi	hypothetical protein	0.0098	0.4156	0.3936
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0098	0.4156	0.4156
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.0088	0.3455	0.3026
Loa Loa (eye worm)	hypothetical protein	0.0186	1	1
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0186	1	1
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0186	1	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0186	1	1
Echinococcus multilocularis	FTZ F1 alpha	0.0186	1	1
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0186	1	1
Loa Loa (eye worm)	hypothetical protein	0.0186	1	1
Onchocerca volvulus	Protein ultraspiracle homolog	0.0186	1	1
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0088	0.3455	0.3209
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0098	0.4156	0.3936
Loa Loa (eye worm)	hypothetical protein	0.0186	1	1
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0186	1	1
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0186	1	1
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0186	1	1
Brugia malayi	Nuclear hormone receptor E75	0.0088	0.3455	0.3209
Loa Loa (eye worm)	nuclear receptor NHR-67	0.0088	0.3455	0.3455
Loa Loa (eye worm)	hypothetical protein	0.0088	0.3455	0.3455
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0186	1	1
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0186	1	1
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0186	1	1
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0039	0.0182	0.5
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.0041	0.0363	0.0363
Loa Loa (eye worm)	hypothetical protein	0.0088	0.3455	0.3455

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 901534