TDR Targets

Basic information

Technical information

TDR Targets ID: 320977
Name: 4-[2-(tert-butylamino)-2-oxoethoxy]-N-(3-fluo rophenyl)naphthalene-1-carboxamide
MW: 394.439 | Formula: C23H23FN2O3
H donors: 2 H acceptors: 2 LogP: 4.41 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: Fc1cccc(c1)NC(=O)c1ccc(c2c1cccc2)OCC(=O)NC(C)(C)C
InChi: 1S/C23H23FN2O3/c1-23(2,3)26-21(27)14-29-20-12-11-19(17-9-4-5-10-18(17)20)22(28)25-16-8-6-7-15(24)13-16/h4-13H,14H2,1-3H3,(H,25,28)(H,26,27)
InChiKey: NNAZXHWRYDVNNY-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

4-[2-(tert-butylamino)-2-oxo-ethoxy]-N-(3-fluorophenyl)naphthalene-1-carboxamide
4-[2-(tert-butylamino)-2-oxoethoxy]-N-(3-fluorophenyl)-1-naphthalenecarboxamide
4-[2-(tert-butylamino)-2-keto-ethoxy]-N-(3-fluorophenyl)-1-naphthamide

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	eukaryotic initiation factor 4A	0.0344	1	1
Echinococcus granulosus	solute carrier family 22	0.0044	0.034	0.0281
Brugia malayi	beta-lactamase family protein	0.0035	0.0061	0.0061
Trichomonas vaginalis	glucose transporter, putative	0.0044	0.034	0.0281
Schistosoma mansoni	glucose transport protein	0.0044	0.034	0.034
Trypanosoma cruzi	glucose transporter, putative	0.0044	0.034	0.0281
Brugia malayi	Major Facilitator Superfamily protein	0.0044	0.034	0.034
Schistosoma mansoni	glucose transporter	0.0044	0.034	0.034
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Entamoeba histolytica	DEAD/DEAH box helicase, putative	0.0344	1	0.5
Echinococcus multilocularis	solute carrier family 2, facilitated glucose	0.0044	0.034	0.0281
Schistosoma mansoni	sugar transporter	0.0044	0.034	0.034
Trypanosoma cruzi	Eukaryotic initiation factor 4A-1	0.0344	1	1
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Mycobacterium leprae	conserved hypothetical protein	0.0035	0.0061	0.5
Trichomonas vaginalis	DEAD box ATP-dependent RNA helicase, putative	0.0344	1	1
Loa Loa (eye worm)	hypothetical protein	0.0044	0.034	0.034
Loa Loa (eye worm)	major facilitator superfamily transporter	0.0044	0.034	0.034
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0225	0.6171	0.6147
Plasmodium vivax	sugar transporter, putative	0.0044	0.034	0.0281
Loa Loa (eye worm)	hypothetical protein	0.0044	0.034	0.034
Mycobacterium tuberculosis	Probable dicarboxylic acid transport integral membrane protein KgtP (dicarboxylate transporter)	0.0044	0.034	0.0281
Schistosoma mansoni	glucose transport protein	0.0044	0.034	0.034
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0044	0.034	0.0281
Trichomonas vaginalis	sugar transport protein, putative	0.0044	0.034	0.0281
Echinococcus granulosus	sodium channel protein	0.0039	0.0169	0.0109
Trypanosoma cruzi	hexose transporter	0.0044	0.034	0.0281
Schistosoma mansoni	sugar transporter	0.0044	0.034	0.034
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Leishmania major	eukaryotic initiation factor 4a, putative	0.0344	1	1
Loa Loa (eye worm)	hypothetical protein	0.0044	0.034	0.034
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0035	0.0061	0.0061
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0061	0.0061
Mycobacterium tuberculosis	Probable cold-shock DeaD-box protein A homolog DeaD (ATP-dependent RNA helicase dead homolog)	0.0344	1	1
Mycobacterium ulcerans	sugar-transport integral membrane protein SugI	0.0044	0.034	1
Mycobacterium ulcerans	integral membrane transport protein	0.0044	0.034	1
Trypanosoma brucei	glucose transporter, putative	0.0044	0.034	0.0281
Loa Loa (eye worm)	hypothetical protein	0.0044	0.034	0.034
Loa Loa (eye worm)	hypothetical protein	0.0049	0.0497	0.0497
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0044	0.034	0.0281
Echinococcus granulosus	Sugar transporter ERD6 protein	0.0044	0.034	0.0281
Trichomonas vaginalis	glucose transporter, putative	0.0044	0.034	0.0281
Leishmania major	glucose transporter/membrane transporter D2, putative	0.0044	0.034	0.0281
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0061	0.0061
Onchocerca volvulus		0.0044	0.034	0.0281
Brugia malayi	beta-lactamase	0.0035	0.0061	0.0061
Schistosoma mansoni	sugar transporter	0.0044	0.034	0.034
Trypanosoma brucei	sugar transporter, putative	0.0044	0.034	0.0281
Plasmodium vivax	RNA helicase-1, putative	0.0344	1	1
Trypanosoma cruzi	sugar transporter, putative	0.0044	0.034	0.0281
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0049	0.0497	0.0497
Brugia malayi	Sugar transporter family protein	0.0044	0.034	0.034
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Trypanosoma brucei	glucose transporter, putative	0.0044	0.034	0.0281
Trichomonas vaginalis	conserved hypothetical protein	0.0044	0.034	0.0281
Onchocerca volvulus		0.0044	0.034	0.0281
Trichomonas vaginalis	conserved hypothetical protein	0.0044	0.034	0.0281
Loa Loa (eye worm)	sugar transporter	0.0044	0.034	0.034
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0061	0.0061
Trypanosoma cruzi	hexose transporter, putative	0.0044	0.034	0.0281
Loa Loa (eye worm)	hypothetical protein	0.0344	1	1
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0049	0.0497	0.0497
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0044	0.034	0.0281
Onchocerca volvulus	Putative transporter	0.0044	0.034	0.0281
Onchocerca volvulus		0.0044	0.034	0.0281
Onchocerca volvulus		0.0044	0.034	0.0281
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0049	0.0497	0.0497
Wolbachia endosymbiont of Brugia malayi	major facilitator superfamily permease	0.0044	0.034	0.5
Loa Loa (eye worm)	hypothetical protein	0.0044	0.034	0.034
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0061	0.0061
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0035	0.0061	0.0061
Schistosoma mansoni	nuclear transcription factor X-box binding 1 (nfx1)	0.0044	0.034	0.034
Leishmania major	glucose transporter, lmgt2	0.0044	0.034	0.0281
Brugia malayi	hypothetical protein	0.0044	0.034	0.034
Trypanosoma brucei	Eukaryotic initiation factor 4A-1	0.0344	1	1
Trichomonas vaginalis	conserved hypothetical protein	0.0044	0.034	0.0281
Echinococcus granulosus	solute carrier family 22	0.0044	0.034	0.0281
Trypanosoma brucei	glucose transporter, putative	0.0044	0.034	0.0281
Trichomonas vaginalis	conserved hypothetical protein	0.0044	0.034	0.0281
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0044	0.034	0.0281
Loa Loa (eye worm)	hypothetical protein	0.0044	0.034	0.034
Leishmania major	calcium channel protein, putative,ion transporter, putative	0.0039	0.0169	0.0109
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Trichomonas vaginalis	conserved hypothetical protein	0.0044	0.034	0.0281
Onchocerca volvulus		0.0044	0.034	0.0281
Schistosoma mansoni	DEAD box ATP-dependent RNA helicase	0.0344	1	1
Giardia lamblia	Translation initiation factor eIF-4A, putative	0.0344	1	1
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Loa Loa (eye worm)	hypothetical protein	0.0044	0.034	0.034
Brugia malayi	major facilitator superfamily protein	0.0044	0.034	0.034
Echinococcus multilocularis	synaptic vesicle 2 protein	0.0044	0.034	0.0281
Echinococcus granulosus	synaptic vesicle 2 protein	0.0044	0.034	0.0281
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Onchocerca volvulus		0.0044	0.034	0.0281
Brugia malayi	Sugar transporter family protein	0.0044	0.034	0.034
Trypanosoma brucei	glucose transporter 1E	0.0044	0.034	0.0281
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0035	0.0061	0.0061
Plasmodium vivax	hexose transporter	0.0044	0.034	0.0281
Mycobacterium leprae	Probable lipase LipE	0.0035	0.0061	0.5
Trypanosoma brucei	myo-inositol/proton symporter (MIT)	0.0044	0.034	0.0281
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Onchocerca volvulus		0.0044	0.034	0.0281
Toxoplasma gondii	sugar transporter ST1	0.0044	0.034	0.0281
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Mycobacterium ulcerans	sugar transporter	0.0044	0.034	1
Leishmania major	glucose transporter, lmgt3	0.0044	0.034	0.0281
Trichomonas vaginalis	DEAD box ATP-dependent RNA helicase, putative	0.0344	1	1
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0044	0.034	0.0281
Loa Loa (eye worm)	beta-lactamase	0.0035	0.0061	0.0061
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0044	0.034	0.0281
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0044	0.034	0.0281
Onchocerca volvulus		0.0044	0.034	0.0281
Brugia malayi	hypothetical protein	0.0044	0.034	0.034
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Echinococcus multilocularis	eukaryotic initiation factor 4A	0.0344	1	1
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Schistosoma mansoni	DEAD box ATP-dependent RNA helicase	0.0344	1	1
Toxoplasma gondii	sugar transporter ST2	0.0044	0.034	0.0281
Leishmania major	eukaryotic initiation factor 4a, putative	0.0344	1	1
Onchocerca volvulus		0.0044	0.034	0.0281
Trichomonas vaginalis	conserved hypothetical protein	0.0044	0.034	0.0281
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0044	0.034	0.0281
Toxoplasma gondii	facilitative glucose transporter GT1	0.0044	0.034	0.0281
Echinococcus granulosus	voltage gated sodium channel Nav1 alpha subunit	0.0039	0.0169	0.0109
Loa Loa (eye worm)	hypothetical protein	0.0044	0.034	0.034
Echinococcus multilocularis	solute carrier family 22	0.0044	0.034	0.0281
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Echinococcus multilocularis	solute carrier family 22	0.0044	0.034	0.0281
Trichomonas vaginalis	conserved hypothetical protein	0.0044	0.034	0.0281
Brugia malayi	Major Facilitator Superfamily protein	0.0044	0.034	0.034
Echinococcus multilocularis	solute carrier family 22	0.0044	0.034	0.0281
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Onchocerca volvulus		0.0044	0.034	0.0281
Trypanosoma cruzi	Eukaryotic initiation factor 4A-1	0.0344	1	1
Onchocerca volvulus		0.0044	0.034	0.0281
Echinococcus multilocularis	eukaryotic initiation factor 4A III	0.0344	1	1
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Trypanosoma brucei	glucose transporter, putative	0.0044	0.034	0.0281
Onchocerca volvulus		0.0044	0.034	0.0281
Leishmania major	hypothetical protein, conserved	0.0044	0.034	0.0281
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Brugia malayi	Sugar transporter family protein	0.0044	0.034	0.034
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Echinococcus granulosus	solute carrier family 22	0.0044	0.034	0.0281
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Schistosoma mansoni	hypothetical protein	0.0044	0.034	0.034
Plasmodium falciparum	eukaryotic initiation factor 4A	0.0344	1	1
Mycobacterium ulcerans	fusion protein of transposase for IS2606 and sialic acid-transport integral membrane protein NanT	0.0044	0.034	1
Mycobacterium tuberculosis	Probable conserved integral membrane transport protein	0.0044	0.034	0.0281
Loa Loa (eye worm)	hypothetical protein	0.0044	0.034	0.034
Trichomonas vaginalis	glucose transporter, putative	0.0044	0.034	0.0281
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Loa Loa (eye worm)	hypothetical protein	0.0044	0.034	0.034
Brugia malayi	major facilitator superfamily protein	0.0044	0.034	0.034
Echinococcus granulosus	eukaryotic initiation factor 4A III	0.0344	1	1
Loa Loa (eye worm)	hypothetical protein	0.0044	0.034	0.034
Schistosoma mansoni	glucose transport protein	0.0044	0.034	0.034
Loa Loa (eye worm)	hypothetical protein	0.0044	0.034	0.034
Brugia malayi	hypothetical protein	0.0044	0.034	0.034
Leishmania major	glucose transporter, lmgt1	0.0044	0.034	0.0281
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0044	0.034	0.0281
Schistosoma mansoni	sugar transporter	0.0044	0.034	0.034
Echinococcus multilocularis	Sugar transporter ERD6 protein	0.0044	0.034	0.0281
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0044	0.034	0.0281
Onchocerca volvulus		0.0044	0.034	0.0281
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Trypanosoma brucei	glucose transporter 2A	0.0044	0.034	0.0281
Trypanosoma brucei	glucose transporter, putative	0.0044	0.034	0.0281
Loa Loa (eye worm)	hypothetical protein	0.0044	0.034	0.034
Onchocerca volvulus		0.0044	0.034	0.0281
Trypanosoma brucei	glucose transporter, putative	0.0044	0.034	0.0281
Echinococcus granulosus	solute carrier family 22	0.0044	0.034	0.0281
Brugia malayi	Major Facilitator Superfamily protein	0.0044	0.034	0.034
Echinococcus multilocularis	sodium channel protein	0.0039	0.0169	0.0109
Onchocerca volvulus	Eukaryotic initiation factor 4A homolog	0.0344	1	1
Onchocerca volvulus		0.0044	0.034	0.0281
Brugia malayi	beta-lactamase family protein	0.0035	0.0061	0.0061
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Trichomonas vaginalis	DEAD box ATP-dependent RNA helicase, putative	0.0344	1	1
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Leishmania major	myo-inositol/proton symporter (MIT)	0.0044	0.034	0.0281
Toxoplasma gondii	eukaryotic initiation factor-4A, putative	0.0344	1	1
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0061	0.0061
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Toxoplasma gondii	sugar transporter ST3	0.0044	0.034	0.0281
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Loa Loa (eye worm)	hypothetical protein	0.0044	0.034	0.034
Echinococcus multilocularis	solute carrier family 22	0.0044	0.034	0.0281
Trypanosoma cruzi	hexose transporter, putative	0.0044	0.034	0.0281
Onchocerca volvulus		0.0044	0.034	0.0281
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Trypanosoma brucei	glucose transporter, putative	0.0044	0.034	0.0281
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Treponema pallidum	ATP-dependent RNA helicase	0.0344	1	0.5
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Loa Loa (eye worm)	sugar transporter	0.0044	0.034	0.034
Trichomonas vaginalis	conserved hypothetical protein	0.0044	0.034	0.0281
Trichomonas vaginalis	myo-inositol transporter, putative	0.0044	0.034	0.0281
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0035	0.0061	0.0061
Trypanosoma brucei	glucose transporter, putative	0.0044	0.034	0.0281
Loa Loa (eye worm)	hypothetical protein	0.0044	0.034	0.034
Loa Loa (eye worm)	major facilitator superfamily transporter	0.0044	0.034	0.034
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0061	0.0061
Trypanosoma cruzi	hexose transporter, putative	0.0044	0.034	0.0281
Toxoplasma gondii	transporter, major facilitator family protein	0.0044	0.034	0.0281
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Trypanosoma cruzi	hexose transporter, putative	0.0044	0.034	0.0281
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281
Trichomonas vaginalis	sugar transporter, putative	0.0044	0.034	0.0281

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 300 uM	Antagonistic activity against HOXA1-PBX1/DNA complex formation by electrophoretic mobility shift assay	ChEMBL.	15225688

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: 11406750

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 320977