TDR Targets

Basic information

Technical information

TDR Targets ID: 778024
Name: methyl 4-(4-chlorophenyl)-7-methyl-2-(trifluo romethyl)pyrido[1,2-e][1,3,5]triazine-2-carbo xylate
MW: 383.752 | Formula: C17H13ClF3N3O2
H donors: 0 H acceptors: 1 LogP: 3.29 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: COC(=O)C1(N=c2ccc(cn2C(=N1)c1ccc(cc1)Cl)C)C(F)(F)F
InChi: 1S/C17H13ClF3N3O2/c1-10-3-8-13-22-16(15(25)26-2,17(19,20)21)23-14(24(13)9-10)11-4-6-12(18)7-5-11/h3-9H,1-2H3
InChiKey: MIFVJZJNIVPXKI-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

4-(4-chlorophenyl)-7-methyl-2-(trifluoromethyl)-2-pyrido[1,2-e][1,3,5]triazinecarboxylic acid methyl ester
4-(4-chlorophenyl)-7-methyl-2-(trifluoromethyl)pyrido[1,2-e][1,3,5]triazine-2-carboxylic acid methyl ester

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	neuronal acetylcholine receptor subunit alpha 4	0.0019	0.0035	0.0181
Brugia malayi	DNA topoisomerase II, alpha isozyme	0.0085	0.1941	1
Loa Loa (eye worm)	acetylcholine receptor alpha subunit	0.0019	0.0035	0.0181
Trichomonas vaginalis	cone cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.004	0.0654	0.3372
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.004	0.0654	0.3372
Onchocerca volvulus	DNA topoisomerase 2 homolog	0.0085	0.1941	1
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.004	0.0654	0.0788
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.004	0.0654	0.3372
Plasmodium vivax	DNA topoisomerase II, putative	0.0085	0.1941	0.1747
Trichomonas vaginalis	DNA topoisomerase II, putative	0.0085	0.1941	1
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.004	0.0654	0.3372
Schistosoma mansoni	nAChR subunit (ShAR1-alpha-like)	0.0019	0.0035	0.0181
Echinococcus multilocularis	dual 3',5' cyclic AMP and GMP phosphodiesterase	0.004	0.0654	0.3372
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.004	0.0654	0.3372
Plasmodium falciparum	DNA gyrase subunit B	0.0364	1	1
Echinococcus granulosus	nicotinic acetylcholine receptor subunit alpha 8	0.0019	0.0035	0.0181
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	0.004	0.0654	0.3372
Schistosoma mansoni	nAChR subunit	0.0019	0.0035	0.0181
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0019	0.0035	0.0181
Echinococcus granulosus	nicotinic acetylcholine receptor beta 1 subunit	0.0019	0.0035	0.0181
Treponema pallidum	DNA gyrase, subunit B (gyrB)	0.0364	1	1
Loa Loa (eye worm)	nicotinic acetylcholine receptor alpha subunit	0.0019	0.0035	0.0181
Loa Loa (eye worm)	ACC-1 protein	0.0019	0.0035	0.0181
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.004	0.0654	0.3372
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.004	0.0654	0.3372
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	0.004	0.0654	0.3372
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.004	0.0654	0.3372
Echinococcus multilocularis	Cys loop ligand gated ion channel subunit	0.0019	0.0035	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0035	0.0181
Schistosoma mansoni	nAChR subunit (ShAR1-beta2-like)	0.0019	0.0035	0.0181
Echinococcus multilocularis	nicotinic acetylcholine receptor beta 1 subunit	0.0019	0.0035	0.0181
Trichomonas vaginalis	conserved hypothetical protein	0.0036	0.051	0.263
Schistosoma mansoni	camp/cgmp cyclic nucleotide phosphodiesterase	0.004	0.0654	0.3372
Trypanosoma brucei	DNA topoisomerase II alpha, putative	0.0059	0.1189	0.1791
Echinococcus multilocularis	glycine receptor subunit beta	0.0019	0.0035	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0035	0.0181
Brugia malayi	GRF zinc finger family protein	0.0026	0.0235	0.1209
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0019	0.0035	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0059	0.1189	0.6125
Echinococcus multilocularis	neuronal acetylcholine receptor subunit alpha 4	0.0019	0.0035	0.0181
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0019	0.0035	0.0181
Trichomonas vaginalis	conserved hypothetical protein	0.0036	0.051	0.263
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0035	0.0181
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.004	0.0654	0.3372
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.004	0.0654	0.3372
Loa Loa (eye worm)	excitatory GABA receptor EXP-1A	0.0019	0.0035	0.0181
Mycobacterium ulcerans	DNA topoisomerase I	0.0026	0.0235	0.005
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.004	0.0654	0.3372
Mycobacterium ulcerans	DNA gyrase subunit B	0.0364	1	1
Trypanosoma cruzi	DNA topoisomerase II, putative	0.0059	0.1189	0.1791
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.004	0.0654	0.3372
Echinococcus multilocularis	rho GTPase activating protein 20	0.0026	0.0235	0.1209
Trypanosoma brucei	DNA topoisomerase II beta, putative	0.0059	0.1189	0.1791
Toxoplasma gondii	DNA topoisomerase 2, putative	0.0085	0.1941	0.3202
Plasmodium vivax	DNA gyrase subunit B, putative	0.0364	1	1
Brugia malayi	DNA topoisomerase III beta-1	0.0026	0.0235	0.1209
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0035	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0059	0.1189	0.6125
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.004	0.0654	0.3372
Schistosoma mansoni	nAChR subunit	0.0019	0.0035	0.0181
Echinococcus multilocularis	nicotinic acetylcholine receptor a11 subunit	0.0019	0.0035	0.0181
Echinococcus granulosus	nAChR subunit	0.0019	0.0035	0.0181
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.004	0.0654	0.3372
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0035	0.0181
Wolbachia endosymbiont of Brugia malayi	DNA gyrase, topoisomerase II, B subunit, GyrB	0.0364	1	1
Mycobacterium tuberculosis	DNA gyrase (subunit B) GyrB (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (type II DNA topoisomerase)	0.0364	1	1
Leishmania major	mitochondrial DNA topoisomerase II	0.021	0.5561	1
Echinococcus granulosus	DNA topoisomerase 2 alpha	0.0085	0.1941	1
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0035	0.0181
Loa Loa (eye worm)	nicotinic acetylcholine receptor non-alpha subunit	0.0019	0.0035	0.0181
Trypanosoma cruzi	mitochondrial DNA topoisomerase II, putative	0.021	0.5561	1
Echinococcus multilocularis	nAChR subunit	0.0019	0.0035	0.0181
Brugia malayi	excitatory GABA receptor EXP-1A	0.0019	0.0035	0.0181
Echinococcus granulosus	DNA topoisomerase 3 alpha	0.0026	0.0235	0.1209
Plasmodium falciparum	DNA topoisomerase 2	0.0085	0.1941	0.1747
Brugia malayi	acetylcholine receptor alpha subunit precursor, putative	0.0019	0.0035	0.0181
Brugia malayi	gamma-aminobutyric-acid receptor beta subunit precursor	0.0019	0.0035	0.0181
Trichomonas vaginalis	cAMP/cGMP cyclic nucleotide phosphodiesterase, putative	0.004	0.0654	0.3372
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0035	0.0181
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0019	0.0035	0.0181
Echinococcus multilocularis	glycine receptor subunit beta	0.0019	0.0035	0.0181
Brugia malayi	Cation transporter family protein	0.0019	0.0035	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0035	0.0181
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.004	0.0654	0.3372
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	0.0028	0.0281	0.1448
Brugia malayi	Probable DNA topoisomerase II	0.0085	0.1941	1
Loa Loa (eye worm)	DNA topoisomerase III	0.0026	0.0235	0.1209
Echinococcus granulosus	glycine receptor subunit beta	0.0019	0.0035	0.0181
Loa Loa (eye worm)	LGC-31 protein	0.0019	0.0035	0.0181
Brugia malayi	DNA gyrase/topoisomerase IV, A subunit family protein	0.0085	0.1941	1
Trypanosoma cruzi	mitochondrial DNA topoisomerase II, putative	0.021	0.5561	1
Loa Loa (eye worm)	TOPoisomerase family member	0.0085	0.1941	1
Echinococcus granulosus	acetylcholine receptor subunit beta 1	0.0019	0.0035	0.0181
Echinococcus multilocularis	nicotinic acetylcholine receptor alpha subunit	0.0019	0.0035	0.0181
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0019	0.0035	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0035	0.0181
Toxoplasma gondii	ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein	0.021	0.5561	1
Echinococcus multilocularis	nicotinic acetylcholine receptor subunit alpha 8	0.0019	0.0035	0.0181
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0019	0.0035	0.0181
Echinococcus granulosus	Cys loop ligand gated ion channel subunit	0.0019	0.0035	0.0181
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.0028	0.0281	0.0087
Brugia malayi	nicotinic acetylcholine receptor beta-1 chain precursor	0.0019	0.0035	0.0181
Onchocerca volvulus	DNA topoisomerase 2 homolog	0.0085	0.1941	1
Trichomonas vaginalis	prokaryotic DNA topoisomerase, putative	0.0026	0.0235	0.1209
Trichomonas vaginalis	cAMP-specific 3,5-cyclic phosphodiesterase, putative	0.004	0.0654	0.3372
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0019	0.0035	0.0181
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.004	0.0654	0.3372
Schistosoma mansoni	nAChR subunit	0.0019	0.0035	0.0181
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0019	0.0035	0.0181
Echinococcus granulosus	nicotinic acetylcholine receptor subunit type	0.0019	0.0035	0.0181
Loa Loa (eye worm)	DNA topoisomerase III beta-1	0.0026	0.0235	0.1209
Brugia malayi	Cation transporter family protein	0.0019	0.0035	0.0181
Trichomonas vaginalis	prokaryotic DNA topoisomerase, putative	0.0026	0.0235	0.1209
Trichomonas vaginalis	conserved hypothetical protein	0.004	0.0654	0.3372
Loa Loa (eye worm)	ACC-1 protein	0.0019	0.0035	0.0181
Brugia malayi	nicotinic acetylcholine receptor alpha subunit, putative	0.0019	0.0035	0.0181
Mycobacterium leprae	Probable DNA gyrase (subunit B) GyrB (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (Type II DNA topoisomerase)	0.0125	0.3104	1
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0035	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0035	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0035	0.0181
Echinococcus multilocularis	DNA topoisomerase 2 alpha	0.0085	0.1941	1
Loa Loa (eye worm)	ligand-Gated ion Channel family member	0.0019	0.0035	0.0181
Schistosoma mansoni	DNA topoisomerase II	0.0085	0.1941	1
Trypanosoma cruzi	DNA topoisomerase II, putative	0.0059	0.1189	0.1791
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0035	0.0181
Trichomonas vaginalis	cAMP-specific 3,5-cyclic phosphodiesterase, putative	0.004	0.0654	0.3372
Echinococcus multilocularis	DNA topoisomerase 3 beta 1	0.0026	0.0235	0.1209
Trypanosoma brucei	DNA topoisomerase ii	0.021	0.5561	1
Schistosoma mansoni	prokaryotic DNA topoisomerase	0.0026	0.0235	0.1209
Brugia malayi	DNA topoisomerase III	0.0026	0.0235	0.1209
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0019	0.0035	0.0181
Brugia malayi	Cation transporter family protein	0.0019	0.0035	0.0181
Schistosoma mansoni	nAChR subunit	0.0019	0.0035	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0035	0.0181
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	0.004	0.0654	0.3372
Echinococcus granulosus	nicotinic acetylcholine receptor alpha subunit	0.0019	0.0035	0.0181
Brugia malayi	acetylcholine receptor protein, alpha-like chain, putative	0.0019	0.0035	0.0181
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0019	0.0035	0.0181
Trichomonas vaginalis	conserved hypothetical protein	0.0036	0.051	0.263
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.004	0.0654	0.3372
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0019	0.0035	0.0181
Schistosoma mansoni	nAChR subunit	0.0019	0.0035	0.0181
Onchocerca volvulus		0.0026	0.0235	0.1047
Schistosoma mansoni	nAChR subunit (ShAR1-beta-like)	0.0019	0.0035	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0035	0.0181
Toxoplasma gondii	hypothetical protein	0.0036	0.051	0.0517
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0035	0.0181
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0019	0.0035	0.0181
Trypanosoma brucei	cAMP-specific phosphodiesterase	0.004	0.0654	0.0788
Trypanosoma brucei	cAMP-specific phosphodiesterase	0.004	0.0654	0.0788
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0019	0.0035	0.0181
Echinococcus granulosus	nicotinic acetylcholine receptor a11 subunit	0.0019	0.0035	0.0181
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.004	0.0654	0.3372
Giardia lamblia	DNA topoisomerase II	0.0074	0.1611	1
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0019	0.0035	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0035	0.0181
Echinococcus granulosus	glycine receptor subunit beta	0.0019	0.0035	0.0181
Onchocerca volvulus	Putative DNA topoisomerase 2, mitochondrial	0.0085	0.1941	1
Echinococcus multilocularis	acetylcholine receptor subunit beta 1	0.0019	0.0035	0.0181
Trichomonas vaginalis	cGMP-inhibited 3,5-cyclic phosphodiesterase, putative	0.004	0.0654	0.3372
Schistosoma mansoni	nAChR subunit	0.0019	0.0035	0.0181
Brugia malayi	acetylcholine receptor, alpha-type subunit unc-38 precursor	0.0019	0.0035	0.0181
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	0.004	0.0654	0.3372
Chlamydia trachomatis	DNA gyrase subunit B	0.0238	0.6379	0.6292
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0035	0.0181
Loa Loa (eye worm)	glutamate-gated chloride channel alpha3A subunit	0.0019	0.0035	0.0181
Entamoeba histolytica	DNA topoisomerase II, putative	0.0085	0.1941	1
Echinococcus granulosus	dual 3'5' cyclic AMP and GMP phosphodiesterase	0.004	0.0654	0.3372
Trichomonas vaginalis	cone cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.004	0.0654	0.3372
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.004	0.0654	0.0788
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0019	0.0035	0.0181
Schistosoma mansoni	nAChR subunit	0.0019	0.0035	0.0181
Schistosoma mansoni	prokaryotic DNA topoisomerase	0.0026	0.0235	0.1209
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0019	0.0035	0.0181
Leishmania major	DNA topoisomerase ii	0.0059	0.1189	0.1791
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0019	0.0035	0.0181
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.004	0.0654	0.3372
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.004	0.0654	0.0788
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0019	0.0035	0.0181
Echinococcus granulosus	DNA topoisomerase 3 beta 1	0.0026	0.0235	0.1209
Brugia malayi	Hypothetical glycine receptor like protein T20B12.9 in chromosome III	0.0019	0.0035	0.0181
Trichomonas vaginalis	cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative	0.0028	0.0281	0.1448
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0035	0.0181

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 778024