TDR Targets

Basic information

Technical information

TDR Targets ID: 665275
Name: 4-(4-tert-butylphenoxy)-N-(2-methylphenyl)but anamide
MW: 325.445 | Formula: C21H27NO2
H donors: 1 H acceptors: 1 LogP: 5.09 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: O=C(Nc1ccccc1C)CCCOc1ccc(cc1)C(C)(C)C
InChi: 1S/C21H27NO2/c1-16-8-5-6-9-19(16)22-20(23)10-7-15-24-18-13-11-17(12-14-18)21(2,3)4/h5-6,8-9,11-14H,7,10,15H2,1-4H3,(H,22,23)
InChiKey: VQJSNPKBVRIYNQ-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-(4-tert-butylphenoxy)-N-(2-methylphenyl)butyramide
AE-641/41111318
ZINC01773492

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)	nuclear receptor nhr-7B	0.0181	0.1453	0.1453
Brugia malayi	Nuclear hormone receptor E75	0.0181	0.1453	0.1453
Mycobacterium ulcerans	cytochrome P450 125A7 Cyp125A7	0.0123	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0384	0.6558	0.6558
Echinococcus granulosus	thyroid hormone receptor alpha	0.0181	0.1453	0.2216
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0384	0.6558	1
Leishmania major	cytochrome p450-like protein	0.0123	0	0.5
Mycobacterium ulcerans	cytochrome P450 150A6 Cyp150A6	0.0123	0	0.5
Brugia malayi	Nuclear hormone receptor-like 1	0.0384	0.6558	0.6558
Mycobacterium ulcerans	cytochrome P450 191A3 Cyp191A3	0.0123	0	0.5
Brugia malayi	ecdysone receptor	0.0181	0.1453	0.1453
Loa Loa (eye worm)	cytochrome P450 family protein	0.052	1	1
Brugia malayi	hypothetical protein	0.0181	0.1453	0.1453
Loa Loa (eye worm)	hypothetical protein	0.0384	0.6558	0.6558
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0384	0.6558	1
Trypanosoma cruzi	cytochrome p450-like protein, putative	0.0123	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0181	0.1453	0.1453
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0384	0.6558	0.6558
Echinococcus granulosus	nuclear receptor subfamily 4 group A	0.0181	0.1453	0.2216
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.0181	0.1453	0.1453
Schistosoma mansoni	nuclear hormone receptor	0.0181	0.1453	0.2216
Brugia malayi	Nuclear hormone receptor E75	0.0181	0.1453	0.1453
Brugia malayi	hypothetical protein	0.0181	0.1453	0.1453
Mycobacterium tuberculosis	Possible cytochrome P450 135A1 Cyp135A1	0.0123	0	0.5
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0384	0.6558	1
Loa Loa (eye worm)	hypothetical protein	0.0181	0.1453	0.1453
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0384	0.6558	0.6558
Mycobacterium ulcerans	cytochrome p450 150 cyp150	0.0123	0	0.5
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0181	0.1453	0.2216
Loa Loa (eye worm)	hypothetical protein	0.0384	0.6558	0.6558
Trypanosoma cruzi	cytochrome P450, putative	0.0123	0	0.5
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0181	0.1453	0.2216
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.0181	0.1453	0.2216
Echinococcus granulosus	nuclear receptor nhr 48	0.0181	0.1453	0.2216
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0384	0.6558	0.6558
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0384	0.6558	0.6558
Onchocerca volvulus		0.0384	0.6558	1
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0181	0.1453	0.2216
Mycobacterium ulcerans	cytochrome P450 123A3 Cyp123A3	0.0123	0	0.5
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0136	0.0311	0.5
Brugia malayi	tailless protein	0.0181	0.1453	0.1453
Mycobacterium tuberculosis	Probable cytochrome P450 125 Cyp125	0.0123	0	0.5
Schistosoma mansoni	nuclear receptor nhr-48	0.0181	0.1453	0.2216
Echinococcus multilocularis	FTZ F1 alpha	0.0384	0.6558	1
Loa Loa (eye worm)	hypothetical protein	0.0203	0.2	0.2
Brugia malayi	nuclear receptor RXR	0.0203	0.2	0.2
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0384	0.6558	1
Loa Loa (eye worm)	hypothetical protein	0.0384	0.6558	0.6558
Brugia malayi	nuclear receptor RXR	0.0181	0.1453	0.1453
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.0145	0.0551	0.0551
Schistosoma mansoni	zinc finger protein	0.0181	0.1453	0.2216
Schistosoma mansoni	nuclear receptor	0.0181	0.1453	0.2216
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0384	0.6558	1
Leishmania major	lanosterol 14-alpha-demethylase, putative	0.0123	0	0.5
Brugia malayi	nuclear receptor NHR-88	0.0181	0.1453	0.1453
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0384	0.6558	0.6558
Mycobacterium ulcerans	cytochrome P450 185A4 Cyp185A4	0.0123	0	0.5
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0384	0.6558	1
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0384	0.6558	0.6558
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0384	0.6558	0.6558
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0384	0.6558	1
Loa Loa (eye worm)	hypothetical protein	0.0181	0.1453	0.1453
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0203	0.2	0.305
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0384	0.6558	1
Loa Loa (eye worm)	hypothetical protein	0.0181	0.1453	0.1453
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0181	0.1453	0.2216
Mycobacterium tuberculosis	Probable cytochrome P450 139 Cyp139	0.0123	0	0.5
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0384	0.6558	0.6558
Mycobacterium ulcerans	cytochrome P450 143A4 Cyp143A4	0.0123	0	0.5
Trypanosoma brucei	cytochrome P450, putative	0.0123	0	0.5
Schistosoma mansoni	nuclear hormone receptor	0.0384	0.6558	1
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0181	0.1453	0.2216
Mycobacterium tuberculosis	Probable cytochrome P450 140 Cyp140	0.0123	0	0.5
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0384	0.6558	0.6558
Mycobacterium leprae	putative cytochrome p450	0.0123	0	0.5
Schistosoma mansoni	thyroid hormone receptor	0.0384	0.6558	1
Mycobacterium tuberculosis	Probable cytochrome P450 124 Cyp124	0.0123	0	0.5
Mycobacterium ulcerans	cytochrome P450 124A1, Cyp124A1	0.0123	0	0.5
Mycobacterium tuberculosis	Probable cytochrome P450 144 Cyp144	0.0123	0	0.5
Mycobacterium ulcerans	cytochrome P450 108B4 Cyp108B4	0.0123	0	0.5
Brugia malayi	steroid hormone receptor	0.0384	0.6558	0.6558
Loa Loa (eye worm)	hypothetical protein	0.0384	0.6558	0.6558
Leishmania major	cytochrome p450-like protein	0.0123	0	0.5
Mycobacterium leprae	Conserved hypothetical protein	0.0123	0	0.5
Schistosoma mansoni	voltage-gated potassium channel	0.0159	0.0887	0.1353
Mycobacterium ulcerans	cytochrome P450 105Q4 Cyp105Q4	0.0123	0	0.5
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0384	0.6558	1
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0203	0.2	0.305
Loa Loa (eye worm)	hypothetical protein	0.0203	0.2	0.2
Mycobacterium ulcerans	cytochrome P450 51B1 Cyp51B1	0.0123	0	0.5
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0384	0.6558	1
Onchocerca volvulus	Bile acid receptor homolog	0.0384	0.6558	1
Leishmania major	cytochrome p450-like protein	0.0123	0	0.5
Schistosoma mansoni	thyroid hormone receptor	0.0384	0.6558	1
Mycobacterium ulcerans	cytochrome P450 187A4 Cyp187A4	0.0123	0	0.5
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0384	0.6558	1
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0203	0.2	0.305
Mycobacterium ulcerans	cytochrome P450 136A2 Cyp136A2	0.0123	0	0.5
Loa Loa (eye worm)	nuclear receptor NHR-67	0.0181	0.1453	0.1453
Trypanosoma cruzi	Lanosterol 14-alpha demethylase	0.0123	0	0.5
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0384	0.6558	0.6558
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0384	0.6558	1
Mycobacterium ulcerans	cytochrome P450 143A3 Cyp143A3	0.0123	0	0.5
Mycobacterium ulcerans	cytochrome P450 188A3 Cyp188A3	0.0123	0	0.5
Mycobacterium tuberculosis	Probable cytochrome P450 137 Cyp137	0.0123	0	0.5
Mycobacterium ulcerans	cytochrome P450 144A4 Cyp144A4	0.0123	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0384	0.6558	0.6558
Loa Loa (eye worm)	hypothetical protein	0.0181	0.1453	0.1453
Loa Loa (eye worm)	hypothetical protein	0.0181	0.1453	0.1453
Loa Loa (eye worm)	hypothetical protein	0.0181	0.1453	0.1453
Mycobacterium tuberculosis	Probable cytochrome P450 141 Cyp141	0.0123	0	0.5
Schistosoma mansoni	nuclear hormone receptor	0.0181	0.1453	0.2216
Mycobacterium tuberculosis	Possible cytochrome P450 135B1 Cyp135B1	0.0123	0	0.5
Onchocerca volvulus	Protein ultraspiracle homolog	0.0384	0.6558	1
Mycobacterium tuberculosis	Possible cytochrome P450 126 Cyp126	0.0123	0	0.5
Brugia malayi	Nuclear hormone receptor-like 1	0.0203	0.2	0.2
Mycobacterium tuberculosis	Probable cytochrome P450 123 Cyp123	0.0123	0	0.5
Brugia malayi	conserved hypotetical protein	0.0181	0.1453	0.1453
Loa Loa (eye worm)	hypothetical protein	0.0181	0.1453	0.1453
Schistosoma mansoni	nuclear receptor	0.0181	0.1453	0.2216
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0145	0.0551	0.0841
Echinococcus multilocularis	nuclear receptor subfamily 4 group A	0.0181	0.1453	0.2216
Loa Loa (eye worm)	hypothetical protein	0.0203	0.2	0.2
Mycobacterium tuberculosis	Probable cytochrome P450 138 Cyp138	0.0123	0	0.5
Echinococcus multilocularis	nuclear receptor nhr 48	0.0181	0.1453	0.2216
Brugia malayi	Nuclear hormone receptor-like 1	0.0203	0.2	0.2
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0384	0.6558	1
Mycobacterium ulcerans	cytochrome P450 142A3 Cyp142A3	0.0123	0	0.5
Mycobacterium tuberculosis	Probable cytochrome P450 132 Cyp132	0.0123	0	0.5
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0384	0.6558	1
Brugia malayi	nuclear hormone receptor family member odr-7	0.0181	0.1453	0.1453
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0384	0.6558	1
Schistosoma mansoni	voltage-gated potassium channel	0.0159	0.0887	0.1353
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0203	0.2	0.2
Loa Loa (eye worm)	hypothetical protein	0.0181	0.1453	0.1453
Loa Loa (eye worm)	steroid hormone receptor	0.0384	0.6558	0.6558
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0384	0.6558	1
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0384	0.6558	0.6558
Schistosoma mansoni	RAR-like nuclear receptor	0.0384	0.6558	1
Loa Loa (eye worm)	hypothetical protein	0.0181	0.1453	0.1453
Loa Loa (eye worm)	hypothetical protein	0.0203	0.2	0.2
Loa Loa (eye worm)	hypothetical protein	0.0203	0.2	0.2
Loa Loa (eye worm)	nuclear hormone receptor	0.0181	0.1453	0.1453
Brugia malayi	photoreceptor-specific nuclear receptor	0.0384	0.6558	0.6558
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0384	0.6558	0.6558
Loa Loa (eye worm)	hypothetical protein	0.0181	0.1453	0.1453
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0384	0.6558	0.6558
Schistosoma mansoni	coup transcription factor	0.0384	0.6558	1
Trypanosoma cruzi	cytochrome P450, putative	0.0123	0	0.5
Mycobacterium ulcerans	cytochrome P450 189A7 Cyp189A7	0.0123	0	0.5
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.0145	0.0551	0.0551
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0384	0.6558	0.6558
Loa Loa (eye worm)	DR-78	0.0181	0.1453	0.1453
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0384	0.6558	0.6558
Mycobacterium tuberculosis	Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM)	0.0123	0	0.5
Brugia malayi	nuclear receptor NHR-67	0.0181	0.1453	0.1453
Mycobacterium tuberculosis	Probable cytochrome P450 monooxygenase 142 Cyp142	0.0123	0	0.5
Mycobacterium ulcerans	cytochrome P450 140A5 Cyp140A5	0.0123	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0384	0.6558	0.6558
Loa Loa (eye worm)	hypothetical protein	0.0384	0.6558	0.6558
Mycobacterium tuberculosis	Probable cytochrome P450 143 Cyp143	0.0123	0	0.5
Brugia malayi	ecdysteroid receptor	0.0384	0.6558	0.6558
Brugia malayi	orphan nuclear receptor NR2E1	0.0181	0.1453	0.1453
Mycobacterium tuberculosis	Probable cytochrome P450 128 Cyp128	0.0123	0	0.5
Echinococcus granulosus	ecdysone induced protein 78C	0.0384	0.6558	1
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0384	0.6558	1
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0384	0.6558	1
Schistosoma mansoni	retinoic acid receptor RXR	0.0384	0.6558	1
Brugia malayi	nuclear receptor NHR-88	0.0384	0.6558	0.6558
Trypanosoma cruzi	Lanosterol 14-alpha demethylase	0.0123	0	0.5
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0384	0.6558	0.6558
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0203	0.2	0.305
Brugia malayi	nuclear hormone receptor family member nhr-6	0.0181	0.1453	0.1453
Brugia malayi	hypothetical protein	0.0203	0.2	0.2
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0384	0.6558	1
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0181	0.1453	0.2216
Brugia malayi	nuclear hormone receptor	0.0181	0.1453	0.1453
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0384	0.6558	0.6558
Mycobacterium ulcerans	cytochrome P450 126A3 Cyp126A3	0.0123	0	0.5
Trypanosoma brucei	Lanosterol 14-alpha demethylase	0.0123	0	0.5
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0384	0.6558	1
Brugia malayi	Steroid receptor seven-up type 2	0.0384	0.6558	0.6558
Loa Loa (eye worm)	hypothetical protein	0.0126	0.0068	0.0068
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0384	0.6558	0.6558
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.0181	0.1453	0.2216
Mycobacterium tuberculosis	Probable cytochrome P450 136 Cyp136	0.0123	0	0.5
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0384	0.6558	1
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0384	0.6558	1
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0384	0.6558	0.6558
Mycobacterium tuberculosis	Probable cytochrome P450 130 Cyp130	0.0123	0	0.5
Echinococcus granulosus	FTZ F1 alpha	0.0384	0.6558	1
Loa Loa (eye worm)	hypothetical protein	0.0181	0.1453	0.1453
Brugia malayi	hypothetical protein	0.0203	0.2	0.2
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0136	0.0311	0.5
Brugia malayi	nuclear hormone receptor	0.0384	0.6558	0.6558
Echinococcus multilocularis	ecdysone induced protein 78C	0.0384	0.6558	1
Toxoplasma gondii	cytochrome p450 superfamily protein	0.0123	0	0.5
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0145	0.0551	0.0841
Mycobacterium tuberculosis	Cytochrome P450 121 Cyp121	0.0123	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0181	0.1453	0.1453
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0384	0.6558	0.6558
Mycobacterium ulcerans	cytochrome P450 187A5 Cyp187A5	0.0123	0	0.5
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.0181	0.1453	0.2216

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 665275