TDR Targets

Basic information

Technical information

TDR Targets ID: 1662201
Name: 4-tert-butyl-N-(2-diethylamino-4-methylquinol in-6-yl)cyclohexane-1-carboxamide
MW: 395.581 | Formula: C25H37N3O
H donors: 1 H acceptors: 2 LogP: 6.44 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: CCN(c1cc(C)c2c(n1)ccc(c2)NC(=O)C1CCC(CC1)C(C)(C)C)CC
InChi: 1S/C25H37N3O/c1-7-28(8-2)23-15-17(3)21-16-20(13-14-22(21)27-23)26-24(29)18-9-11-19(12-10-18)25(4,5)6/h13-16,18-19H,7-12H2,1-6H3,(H,26,29)
InChiKey: AUVKYNZVPHCBOG-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-tert-butyl-N-(2-diethylamino-4-methyl-6-quinolyl)cyclohexane-1-carboxamide
4-tert-butyl-N-(2-diethylamino-4-methyl-6-quinolyl)-1-cyclohexanecarboxamide
4-tert-butyl-N-(2-diethylamino-4-methyl-quinolin-6-yl)cyclohexane-1-carboxamide

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
Trichomonas vaginalis	glucosylceramidase, putative	0.0312	0.0787	1
Trichomonas vaginalis	AGC family protein kinase	0.0247	0.0309	0.3925
Brugia malayi	RasGEF domain containing protein	0.0275	0.0515	0.0436
Loa Loa (eye worm)	hypothetical protein	0.132	0.8189	0.8184
Onchocerca volvulus		0.132	0.8189	1
Echinococcus multilocularis	Protein kinase C, brain isozyme	0.0874	0.491	0.9757
Loa Loa (eye worm)	hypothetical protein	0.0418	0.1566	0.154
Trichomonas vaginalis	serine/threonine-protein kinase sgk, putative	0.0241	0.027	0.3428
Brugia malayi	O-Glycosyl hydrolase family 30 protein	0.0312	0.0787	0.1013
Loa Loa (eye worm)	AGC/PKN protein kinase	0.0247	0.0309	0.0279
Toxoplasma gondii	AGC kinase	0.0247	0.0309	0.5
Schistosoma mansoni	serine/threonine protein kinase	0.0247	0.0309	0.0556
Echinococcus granulosus	Ribosomal protein S6 kinase beta 2	0.0247	0.0309	0.0556
Echinococcus multilocularis	serine:threonine protein kinase N2	0.0681	0.3499	0.6935
Trichomonas vaginalis	glucosylceramidase, putative	0.0312	0.0787	1
Loa Loa (eye worm)	hypothetical protein	0.132	0.8189	0.8184
Schistosoma mansoni	atypical protein kinase C	0.0434	0.1686	0.331
Trichomonas vaginalis	AGC family protein kinase	0.0247	0.0309	0.3925
Echinococcus granulosus	RNA directed DNA polymerase	0.0418	0.1566	0.307
Brugia malayi	protein kinase C II.	0.089	0.5032	1
Echinococcus granulosus	serine:threonine protein kinase N2	0.0247	0.0309	0.0556
Trichomonas vaginalis	glucosylceramidase, putative	0.0312	0.0787	1
Brugia malayi	Protein kinase c protein 2	0.0632	0.3138	0.5991
Echinococcus multilocularis	telomerase reverse transcriptase subunit	0.0418	0.1566	0.307
Schistosoma mansoni	serine/threonine protein kinase	0.089	0.5032	1
Trichomonas vaginalis	AGC family protein kinase	0.0247	0.0309	0.3925
Trypanosoma brucei	rac serine-threonine kinase, putative	0.0247	0.0309	0.5
Trichomonas vaginalis	glucosylceramidase, putative	0.0216	0.0081	0.1027
Trichomonas vaginalis	AGC family protein kinase	0.0247	0.0309	0.3925
Trichomonas vaginalis	AGC family protein kinase	0.0247	0.0309	0.3925
Trichomonas vaginalis	AGC family protein kinase	0.0247	0.0309	0.3925
Echinococcus multilocularis	serine:threonine protein kinase N2	0.0247	0.0309	0.0556
Schistosoma mansoni	serine/threonine protein kinase	0.0874	0.491	0.9757
Loa Loa (eye worm)	hypothetical protein	0.0606	0.2944	0.2922
Echinococcus multilocularis	protein kinase c iota type	0.0434	0.1686	0.331
Loa Loa (eye worm)	hypothetical protein	0.132	0.8189	0.8184
Echinococcus granulosus	serine:threonine protein kinase N2	0.044	0.1727	0.3392
Loa Loa (eye worm)	AGC/AKT protein kinase	0.0247	0.0309	0.0279
Echinococcus granulosus	ribosomal protein S6 kinase alpha 3	0.0247	0.0309	0.0556
Echinococcus multilocularis	protein kinase c epsilon type	0.089	0.5032	1
Loa Loa (eye worm)	AGC/RSK/RSK protein kinase	0.0247	0.0309	0.0279
Echinococcus multilocularis	ribosomal protein s6 kinase beta 1	0.0247	0.0309	0.0556
Echinococcus multilocularis	serine threonine protein kinase	0.0686	0.3533	0.7003
Schistosoma mansoni	serine/threonine protein kinase	0.0247	0.0309	0.0556
Trichomonas vaginalis	glucosylceramidase, putative	0.0312	0.0787	1
Loa Loa (eye worm)	AGC/PKC/ALPHA protein kinase	0.0445	0.1761	0.1736
Loa Loa (eye worm)	AGC/NDR protein kinase	0.0247	0.0309	0.0279
Loa Loa (eye worm)	RasGEF domain-containing protein	0.0462	0.1892	0.1867
Trichomonas vaginalis	AGC family protein kinase	0.0247	0.0309	0.3925
Echinococcus granulosus	protein kinase c iota type	0.0434	0.1686	0.331
Loa Loa (eye worm)	AGC/RSK/P70 protein kinase	0.0247	0.0309	0.0279
Echinococcus granulosus	protein kinase C gamma type	0.0686	0.3533	0.7003
Echinococcus granulosus	NDR protein kinase	0.0247	0.0309	0.0556
Echinococcus multilocularis	Ribosomal protein S6 kinase beta 2	0.0247	0.0309	0.0556
Loa Loa (eye worm)	AGC/RSK/MSK protein kinase	0.0247	0.0309	0.0279
Echinococcus granulosus	protein kinase c epsilon type	0.089	0.5032	1
Entamoeba histolytica	PH domain containing protein kinase, putative	0.044	0.1727	1
Loa Loa (eye worm)	O-glycosyl hydrolase family 30 protein	0.0312	0.0787	0.0758
Trichomonas vaginalis	glucosylceramidase, putative	0.0216	0.0081	0.1027
Schistosoma mansoni	serine/threonine protein kinase	0.0247	0.0309	0.0556
Schistosoma mansoni	serine/threonine protein kinase	0.0247	0.0309	0.0556
Loa Loa (eye worm)	AGC/PKC/ETA protein kinase	0.089	0.5032	0.5016
Trichomonas vaginalis	AGC family protein kinase	0.0247	0.0309	0.3925
Loa Loa (eye worm)	hypothetical protein	0.1508	0.9566	0.9565
Schistosoma mansoni	serine/threonine kinase	0.0247	0.0309	0.0556
Trichomonas vaginalis	AGC family protein kinase	0.0247	0.0309	0.3925
Onchocerca volvulus		0.0209	0.0031	0.0038
Schistosoma mansoni	serine/threonine protein kinase	0.0874	0.491	0.9757
Trichomonas vaginalis	AGC family protein kinase	0.0247	0.0309	0.3925
Echinococcus multilocularis	serine:threonine protein kinase 38	0.0247	0.0309	0.0556
Loa Loa (eye worm)	AGC/DMPK/GEK protein kinase	0.0247	0.0309	0.0279
Echinococcus granulosus	ribosomal protein s6 kinase beta 1	0.0247	0.0309	0.0556
Echinococcus granulosus	Protein kinase C brain isozyme	0.0874	0.491	0.9757
Echinococcus multilocularis	RNA directed DNA polymerase	0.0418	0.1566	0.307
Trichomonas vaginalis	glucosylceramidase, putative	0.0312	0.0787	1
Trichomonas vaginalis	glucosylceramidase, putative	0.0312	0.0787	1
Echinococcus multilocularis	ribosomal protein S6 kinase alpha 3	0.0247	0.0309	0.0556
Trichomonas vaginalis	AGC family protein kinase	0.0247	0.0309	0.3925

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: CHEMBL2095111

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 1662201