TDR Targets

Basic information

Technical information

TDR Targets ID: 864312
Name: N-[2-(methyl-(phenylmethyl)amino)ethyl]-2-pyr idin-3-ylquinoline-4-carboxamide
MW: 396.484 | Formula: C25H24N4O
H donors: 1 H acceptors: 3 LogP: 3.59 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: CN(Cc1ccccc1)CCNC(=O)c1cc(nc2c1cccc2)c1cccnc1
InChi: 1S/C25H24N4O/c1-29(18-19-8-3-2-4-9-19)15-14-27-25(30)22-16-24(20-10-7-13-26-17-20)28-23-12-6-5-11-21(22)23/h2-13,16-17H,14-15,18H2,1H3,(H,27,30)
InChiKey: GCABEPADACICLT-UHFFFAOYSA-N

Network

Hover on a compound node to display the structore

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

This is a work in progress. Come back soon to try this features!

Clustering layers

This is a work in progress. Come back soon to try this features!

Synonyms

N-[2-(methyl-(phenylmethyl)amino)ethyl]-2-(3-pyridyl)quinoline-4-carboxamide
N-[2-(methyl-(phenylmethyl)amino)ethyl]-2-(3-pyridyl)-4-quinolinecarboxamide
N-[2-(benzyl-methyl-amino)ethyl]-2-(3-pyridyl)cinchoninamide
N-[2-(methyl-(phenylmethyl)amino)ethyl]-2-pyridin-3-yl-quinoline-4-carboxamide
EU-0064864

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
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.011	0.0739	0.0782
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0325	0.0337
Onchocerca volvulus	Bile acid receptor homolog	0.011	0.0739	0.4747
Loa Loa (eye worm)	hypothetical protein	0.0058	0.0369	0.0383
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.011	0.0739	0.0782
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.011	0.0739	0.1527
Schistosoma mansoni	thyroid hormone receptor	0.0796	0.5629	1
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0058	0.0369	0.0656
Brugia malayi	Nuclear hormone receptor-like 1	0.1357	0.963	0.963
Loa Loa (eye worm)	hypothetical protein	0.0175	0.1198	0.1245
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.011	0.0739	0.1527
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.011	0.0739	0.0739
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.011	0.0739	0.4747
Loa Loa (eye worm)	hypothetical protein	0.0058	0.0369	0.0383
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.011	0.0739	0.1314
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0058	0.0369	0.0762
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.0052	0.0325	0.0325
Echinococcus granulosus	thyroid hormone receptor alpha	0.0052	0.0325	0.067
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0052	0.0325	0.0577
Loa Loa (eye worm)	nuclear receptor NHR-67	0.0052	0.0325	0.0337
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0325	0.0337
Loa Loa (eye worm)	hypothetical protein	0.011	0.0739	0.0768
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0052	0.0325	0.067
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0325	0.0337
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.011	0.0739	0.0739
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0052	0.0325	0.067
Brugia malayi	nuclear receptor RXR	0.0052	0.0325	0.0325
Loa Loa (eye worm)	hypothetical protein	0.0058	0.0369	0.0383
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.011	0.0739	0.0739
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0052	0.0325	0.0577
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.011	0.0739	0.0739
Echinococcus granulosus	ecdysone induced protein 78C	0.011	0.0739	0.1527
Brugia malayi	Steroid receptor seven-up type 2	0.011	0.0739	0.0739
Brugia malayi	ecdysteroid receptor	0.011	0.0739	0.0739
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.011	0.0739	0.0739
Brugia malayi	nuclear receptor NHR-67	0.0052	0.0325	0.0325
Brugia malayi	hypothetical protein	0.0052	0.0325	0.0325
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.011	0.0739	0.0782
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.011	0.0739	0.1527
Loa Loa (eye worm)	hypothetical protein	0.011	0.0739	0.0768
Brugia malayi	nuclear hormone receptor family member nhr-6	0.0052	0.0325	0.0325
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.011	0.0739	0.0782
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0325	0.0337
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0325	0.0337
Echinococcus multilocularis	FTZ F1 alpha	0.011	0.0739	0.1314
Schistosoma mansoni	hypothetical protein	0.0686	0.4844	0.852
Brugia malayi	conserved hypotetical protein	0.0052	0.0325	0.0325
Schistosoma mansoni	RAR-like nuclear receptor	0.011	0.0739	0.0782
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.011	0.0739	0.0768
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.011	0.0739	0.0739
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0052	0.0325	0.0577
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.011	0.0739	0.1314
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.011	0.0739	0.1527
Brugia malayi	nuclear receptor NHR-88	0.0052	0.0325	0.0325
Brugia malayi	hypothetical protein	0.0058	0.0369	0.0369
Echinococcus multilocularis	ecdysone induced protein 78C	0.011	0.0739	0.1314
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.011	0.0739	0.0739
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0325	0.0337
Loa Loa (eye worm)	nuclear receptor nhr-7B	0.0052	0.0325	0.0337
Echinococcus multilocularis	nuclear receptor subfamily 4 group A	0.0052	0.0325	0.0577
Brugia malayi	hypothetical protein	0.0058	0.0369	0.0369
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0325	0.0337
Loa Loa (eye worm)	hypothetical protein	0.011	0.0739	0.0768
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.011	0.0739	0.0768
Echinococcus granulosus	Mitotic checkpoint protein PRCC C terminal	0.0686	0.4844	1
Brugia malayi	steroid hormone receptor	0.011	0.0739	0.0739
Brugia malayi	nuclear hormone receptor family member odr-7	0.0052	0.0325	0.0325
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.011	0.0739	0.0739
Loa Loa (eye worm)	steroid hormone receptor	0.011	0.0739	0.0768
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.011	0.0739	0.0739
Brugia malayi	ecdysone receptor	0.0052	0.0325	0.0325
Brugia malayi	nuclear receptor NHR-88	0.011	0.0739	0.0739
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.011	0.0739	0.1314
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.011	0.0739	0.0739
Schistosoma mansoni	thyroid hormone receptor	0.0796	0.5629	1
Brugia malayi	tailless protein	0.0052	0.0325	0.0325
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0058	0.0369	0.0084
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.011	0.0739	0.0768
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0325	0.0337
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.011	0.0739	0.0768
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.011	0.0739	0.0782
Loa Loa (eye worm)	DR-78	0.0052	0.0325	0.0337
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.011	0.0739	0.0782
Echinococcus granulosus	FTZ F1 alpha	0.011	0.0739	0.1527
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.011	0.0739	0.0739
Loa Loa (eye worm)	hypothetical protein	0.1351	0.9585	0.9954
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.011	0.0739	0.1314
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0325	0.0337
Schistosoma mansoni	retinoic acid receptor RXR	0.011	0.0739	0.0782
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0796	0.5629	1
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.1357	0.963	1
Brugia malayi	hypothetical protein	0.0052	0.0325	0.0325
Schistosoma mansoni	coup transcription factor	0.011	0.0739	0.0782
Onchocerca volvulus		0.011	0.0739	0.4747
Loa Loa (eye worm)	hypothetical protein	0.011	0.0739	0.0768
Brugia malayi	nuclear hormone receptor	0.0052	0.0325	0.0325
Loa Loa (eye worm)	hypothetical protein	0.0058	0.0369	0.0383
Brugia malayi	photoreceptor-specific nuclear receptor	0.011	0.0739	0.0739
Brugia malayi	orphan nuclear receptor NR2E1	0.0052	0.0325	0.0325
Onchocerca volvulus		0.0175	0.1198	1
Onchocerca volvulus	Protein ultraspiracle homolog	0.011	0.0739	0.4747
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.011	0.0739	0.0739
Brugia malayi	Nuclear hormone receptor E75	0.0052	0.0325	0.0325
Echinococcus granulosus	nuclear receptor nhr 48	0.0052	0.0325	0.067
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.011	0.0739	0.1314
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0325	0.0337
Loa Loa (eye worm)	hypothetical protein	0.011	0.0739	0.0768
Brugia malayi	hypothetical protein	0.0175	0.1198	0.1198
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.011	0.0739	0.1527
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.011	0.0739	0.1527
Brugia malayi	Nuclear hormone receptor-like 1	0.1357	0.963	0.963
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0325	0.0337
Loa Loa (eye worm)	nuclear hormone receptor	0.0052	0.0325	0.0337
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.011	0.0739	0.0739
Loa Loa (eye worm)	hypothetical protein	0.011	0.0739	0.0768
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0058	0.0369	0.0084
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.011	0.0739	0.1314
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.011	0.0739	0.0768
Loa Loa (eye worm)	hypothetical protein	0.011	0.0739	0.0768
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.011	0.0739	0.0768
Echinococcus granulosus	nuclear receptor subfamily 4 group A	0.0052	0.0325	0.067
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0052	0.0325	0.067
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.0052	0.0325	0.0577
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.011	0.0739	0.0768
Loa Loa (eye worm)	hypothetical protein	0.0058	0.0369	0.0383
Brugia malayi	Nuclear hormone receptor E75	0.0052	0.0325	0.0325
Echinococcus multilocularis	nuclear receptor nhr 48	0.0052	0.0325	0.0577
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.011	0.0739	0.1527
Brugia malayi	nuclear receptor RXR	0.0058	0.0369	0.0369
Schistosoma mansoni	nuclear hormone receptor	0.011	0.0739	0.0782
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0325	0.0337
Brugia malayi	nuclear hormone receptor	0.011	0.0739	0.0739
Schistosoma mansoni	steroid hormone receptor ad4bp	0.011	0.0739	0.0782
Echinococcus multilocularis	Mitotic checkpoint protein PRCC, C terminal	0.0686	0.4844	0.8605
Loa Loa (eye worm)	hypothetical protein	0.011	0.0739	0.0768

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

Search by Saint Jude

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 864312