TDR Targets

Basic information

Technical information

TDR Targets ID: 1509074
Name: tert-butyl 4-[3-(4-methylsulfonylphenyl)triaz olo[4,5-e]pyrimidin-7-yl]oxypiperidine-1-carb oxylate
MW: 474.533 | Formula: C21H26N6O5S
H donors: 0 H acceptors: 7 LogP: 2.37 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: O=C(N1CCC(CC1)Oc1ncnc2c1nnn2c1ccc(cc1)S(=O)(=O)C)OC(C)(C)C
InChi: 1S/C21H26N6O5S/c1-21(2,3)32-20(28)26-11-9-15(10-12-26)31-19-17-18(22-13-23-19)27(25-24-17)14-5-7-16(8-6-14)33(4,29)30/h5-8,13,15H,9-12H2,1-4H3
InChiKey: RNXQXVJILIUHTG-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-[[3-(4-methylsulfonylphenyl)-7-triazolo[4,5-e]pyrimidinyl]oxy]-1-piperidinecarboxylic acid tert-butyl ester
4-[3-(4-mesylphenyl)triazolo[4,5-e]pyrimidin-7-yl]oxypiperidine-1-carboxylic acid tert-butyl ester
tert-butyl 4-[[3-(4-methylsulfonylphenyl)-[1,2,3]triazolo[4,5-e]pyrimidin-7-yl]oxy]piperidine-1-carboxylate

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	G protein-coupled receptor 119	Starlite/ChEMBL	References
Rattus norvegicus	Glucose-dependent insulinotropic receptor	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Schistosoma japonicum	ko:K04136 adrenergic receptor, alpha 1b, putative	Glucose-dependent insulinotropic receptor	468 aa	383 aa	21.4 %
Brugia malayi	follicle stimulating hormone receptor	G protein-coupled receptor 119	335 aa	274 aa	22.3 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Onchocerca volvulus		0.0026	0.0134	0.2725
Trypanosoma cruzi	dihydrolipoyl dehydrogenase, putative	0.0016	0.005	0.0102
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0134	0.0736
Brugia malayi	alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase	0.0012	0.0015	0.0084
Trichomonas vaginalis	phosphofructokinase, putative	0.0106	0.0786	0.1995
Trichomonas vaginalis	thymidine kinase, putative	0.0489	0.3897	1
Brugia malayi	thymidylate kinase	0.007	0.0493	0.2702
Loa Loa (eye worm)	glutathione reductase	0.0046	0.0296	0.1624
Brugia malayi	dihydrolipoyl dehydrogenase, mitochondrial precursor, putative	0.0016	0.005	0.0274
Echinococcus multilocularis	ribonuclease H1	0.0065	0.0445	0.1658
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0016	0.005	0.0102
Mycobacterium tuberculosis	Probable reductase	0.0106	0.0779	0.8837
Toxoplasma gondii	phosphofructokinase domain-containing protein	0.0029	0.0153	0.2618
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0018	0.0069	0.0258
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0106	0.0779	0.8837
Brugia malayi	follicle stimulating hormone receptor	0.0234	0.1824	1
Schistosoma mansoni	phosphoglucomutase	0.0065	0.0445	0.0445
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0018	0.0069	0.0262
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	0.0018	0.0069	0.0152
Trypanosoma brucei	ATP-dependent 6-phosphofructokinase, glycosomal	0.0106	0.0786	0.1995
Trichomonas vaginalis	ap endonuclease, putative	0.0018	0.0069	0.0152
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0019	0.0105
Leishmania major	thymidylate kinase-like protein	0.007	0.0493	0.1242
Trichomonas vaginalis	phosphofructokinase, putative	0.0106	0.0786	0.1995
Mycobacterium leprae	PROBABLE NADH DEHYDROGENASE NDH	0.0106	0.0779	0.7488
Trichomonas vaginalis	thymidine kinase, putative	0.0489	0.3897	1
Schistosoma mansoni	blooms syndrome DNA helicase	0.0016	0.0054	0.0054
Leishmania major	trypanothione reductase	0.0046	0.0296	0.0736
Wolbachia endosymbiont of Brugia malayi	thymidylate kinase	0.007	0.0493	1
Trichomonas vaginalis	phosphofructokinase, putative	0.0029	0.0153	0.0368
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	0.0018	0.0069	0.0234
Brugia malayi	6-phosphofructokinase	0.0106	0.0786	0.4306
Brugia malayi	Bloom's syndrome protein homolog	0.0021	0.0089	0.0491
Schistosoma mansoni	family A2 unassigned peptidase (A02 family)	0.0225	0.1752	0.1752
Echinococcus multilocularis	dihydrolipoamide dehydrogenase	0.0016	0.005	0.0186
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0018	0.0069	0.0258
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0018	0.0069	0.0761
Schistosoma mansoni	hypothetical protein	0.0377	0.299	0.299
Plasmodium falciparum	ADP-dependent DNA helicase RecQ	0.0018	0.0069	0.0425
Echinococcus granulosus	thioredoxin glutathione reductase	0.0046	0.0296	0.1103
Trypanosoma brucei	unspecified product	0.0073	0.0515	0.1298
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0106	0.0779	0.8837
Toxoplasma gondii	thymidylate kinase	0.007	0.0493	1
Leishmania major	acetoin dehydrogenase e3 component-like protein	0.0016	0.005	0.0102
Trypanosoma cruzi	UMP-CMP kinase, mitochondrial, putative	0.0028	0.0145	0.0345
Echinococcus granulosus	bloom syndrome protein	0.0021	0.0089	0.0333
Echinococcus granulosus	dihydrolipoamide dehydrogenase	0.0016	0.005	0.0186
Trypanosoma cruzi	trypanothione reductase, putative	0.0016	0.005	0.0102
Schistosoma mansoni	thymidylate kinase	0.007	0.0493	0.0493
Toxoplasma gondii	pyruvate dehydrogenase complex subunit PDH-E3II	0.0016	0.005	0.0369
Trypanosoma brucei	thymidylate kinase, putative	0.007	0.0493	0.1242
Trypanosoma cruzi	dihydrolipoyl dehydrogenase, putative	0.0016	0.005	0.0102
Trypanosoma brucei	ribonuclease H1	0.0065	0.0445	0.1119
Trypanosoma brucei	RNA helicase, putative	0.0377	0.299	0.7668
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0117	0.0875	1
Trichomonas vaginalis	phosphofructokinase, putative	0.0029	0.0153	0.0368
Plasmodium vivax	dihydrolipoyl dehydrogenase, mitochondrial, putative	0.0016	0.005	0.034
Trypanosoma cruzi	ATP-dependent 6-phosphofructokinase, glycosomal	0.0106	0.0786	0.1995
Giardia lamblia	Thymidine kinase	0.0489	0.3897	1
Loa Loa (eye worm)	phosphofructokinase	0.0106	0.0786	0.4306
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0018	0.0069	0.0436
Chlamydia trachomatis	fructose-6-phosphate phosphotransferase	0.0029	0.0153	0.2335
Mycobacterium tuberculosis	Probable dehydrogenase	0.0106	0.0779	0.8837
Trichomonas vaginalis	phosphofructokinase, putative	0.0029	0.0153	0.0368
Trichomonas vaginalis	thymidylate kinase, putative	0.007	0.0493	0.1242
Loa Loa (eye worm)	6-phosphofructokinase	0.0106	0.0786	0.4306
Mycobacterium leprae	PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE)	0.0106	0.0786	0.7663
Leishmania major	ribonuclease H1, putative	0.0065	0.0445	0.1119
Mycobacterium ulcerans	6-phosphofructokinase	0.0106	0.0786	1
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0234	0.1824	1
Toxoplasma gondii	thioredoxin reductase	0.0046	0.0296	0.5722
Trichomonas vaginalis	6-phosphofructokinase, putative	0.0029	0.0153	0.0368
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.0018	0.0069	0.0152
Trypanosoma cruzi	ribonuclease H1, putative	0.0065	0.0445	0.1119
Plasmodium falciparum	ATP-dependent 6-phosphofructokinase	0.0029	0.0153	0.2335
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0117	0.0875	1
Echinococcus granulosus	ribonuclease H1	0.0065	0.0445	0.1658
Echinococcus granulosus	6 phosphofructokinase	0.0106	0.0786	0.2926
Echinococcus granulosus	lamin	0.0026	0.0134	0.05
Trichomonas vaginalis	ribonuclease H1, putative	0.0065	0.0445	0.1119
Giardia lamblia	Ribonuclease H	0.0065	0.0445	0.1027
Leishmania major	dihydrolipoamide dehydrogenase, putative	0.0016	0.005	0.0102
Plasmodium falciparum	thioredoxin reductase	0.0046	0.0296	0.5558
Echinococcus granulosus	thymidylate kinase	0.007	0.0493	0.1836
Trypanosoma brucei	thymidylate kinase, putative	0.007	0.0493	0.1242
Echinococcus multilocularis	lamin dm0	0.0026	0.0134	0.05
Entamoeba histolytica	thymidine kinase, putative	0.0489	0.3897	1
Treponema pallidum	thymidylate kinase (tmk)	0.007	0.0493	0.6022
Echinococcus multilocularis	bloom syndrome protein	0.0021	0.0089	0.0333
Schistosoma mansoni	hypothetical protein	0.034	0.2685	0.2685
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0016	0.005	0.0102
Trichomonas vaginalis	DNA helicase recq, putative	0.0021	0.0089	0.0204
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0016	0.005	0.0102
Toxoplasma gondii	ribonuclease HI protein	0.0065	0.0445	0.896
Trypanosoma cruzi	thymidine kinase, putative	0.0489	0.3897	1
Trypanosoma brucei	hypothetical protein, conserved	0.0073	0.0515	0.1298
Schistosoma mansoni	intermediate filament proteins	0.0026	0.0134	0.0134
Trichomonas vaginalis	phosphofructokinase, putative	0.0029	0.0153	0.0368
Leishmania major	dihydrolipoamide dehydrogenase, putative	0.0016	0.005	0.0102
Echinococcus multilocularis	cytoplasmic intermediate filament protein	0.0013	0.0023	0.0086
Trypanosoma brucei	thymidine kinase	0.0489	0.3897	1
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.0018	0.0069	0.0152
Mycobacterium tuberculosis	Probable oxidoreductase	0.0117	0.0875	1
Echinococcus granulosus	lamin dm0	0.0026	0.0134	0.05
Trichomonas vaginalis	DNA helicase recq1, putative	0.0021	0.0089	0.0204
Treponema pallidum	diphosphate--fructose-6-phosphate 1-phosphotransferase	0.0106	0.0786	1
Brugia malayi	Intermediate filament tail domain containing protein	0.0026	0.0134	0.0736
Plasmodium vivax	6-phosphofructokinase, putative	0.0029	0.0153	0.2596
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0106	0.0779	0.8837
Entamoeba histolytica	exodeoxyribonuclease III, putative	0.0018	0.0069	0.0152
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.0018	0.0069	0.0152
Plasmodium vivax	thymidylate kinase, putative	0.007	0.0493	1
Plasmodium falciparum	thymidylate kinase	0.007	0.0493	1
Plasmodium vivax	thioredoxin reductase, putative	0.0046	0.0296	0.5709
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0016	0.005	0.0102
Toxoplasma gondii	exonuclease III APE	0.0018	0.0069	0.0788
Schistosoma mansoni	hypothetical protein	0.034	0.2685	0.2685
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0016	0.005	0.0102
Mycobacterium tuberculosis	Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase)	0.0106	0.0786	0.8918
Plasmodium vivax	6-phosphofructokinase, putative	0.0029	0.0153	0.2596
Brugia malayi	RNase H family protein	0.0065	0.0445	0.244
Trichomonas vaginalis	thymidylate kinase, putative	0.007	0.0493	0.1242
Loa Loa (eye worm)	cytoplasmic intermediate filament protein	0.0014	0.0035	0.019
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0018	0.0069	0.038
Trichomonas vaginalis	phosphofructokinase, putative	0.0106	0.0786	0.1995
Echinococcus multilocularis	geminin	0.034	0.2685	1
Trichomonas vaginalis	thymidine kinase, putative	0.0489	0.3897	1
Loa Loa (eye worm)	thymidylate kinase	0.007	0.0493	0.2702
Entamoeba histolytica	phosphofructokinase, putative	0.0106	0.0786	0.1995
Loa Loa (eye worm)	hypothetical protein	0.0013	0.0023	0.0127
Brugia malayi	6-phosphofructokinase	0.0106	0.0786	0.4306
Treponema pallidum	ribonuclease H (rnhA)	0.0065	0.0445	0.5372
Trypanosoma cruzi	UMP-CMP kinase, mitochondrial, putative	0.0028	0.0145	0.0345
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0019	0.0105
Schistosoma mansoni	6-phosphofructokinase	0.0106	0.0786	0.0786
Wolbachia endosymbiont of Brugia malayi	ribonuclease HI	0.0065	0.0445	0.892
Loa Loa (eye worm)	thioredoxin reductase	0.0046	0.0296	0.1624
Trypanosoma cruzi	trypanothione reductase, putative	0.0046	0.0296	0.0736
Schistosoma mansoni	phosphoglucomutase	0.0065	0.0445	0.0445
Schistosoma mansoni	lamin	0.0026	0.0134	0.0134
Treponema pallidum	diphosphate--fructose-6-phosphate 1-phosphotransferase	0.0029	0.0153	0.1406
Giardia lamblia	Pyrophosphate-fructose 6-phosphate 1-phosphotransferase alpha subunit	0.0029	0.0153	0.0269
Trypanosoma brucei	dihydrolipoamide dehydrogenase	0.0016	0.005	0.0102
Echinococcus multilocularis	6 phosphofructokinase	0.0106	0.0786	0.2926
Loa Loa (eye worm)	RecQ helicase	0.0021	0.0089	0.0491
Trichomonas vaginalis	ap endonuclease, putative	0.0018	0.0069	0.0152
Plasmodium falciparum	glutathione reductase	0.0046	0.0296	0.5558
Plasmodium vivax	glutathione reductase, putative	0.0046	0.0296	0.5709
Brugia malayi	exodeoxyribonuclease III family protein	0.0018	0.0069	0.038
Trypanosoma brucei	dihydrolipoamide dehydrogenase	0.0016	0.005	0.0102
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0055	0.0302
Onchocerca volvulus		0.0026	0.0134	0.2725
Schistosoma mansoni	ap endonuclease	0.0018	0.0069	0.0069
Loa Loa (eye worm)	hypothetical protein	0.0026	0.013	0.0715
Echinococcus multilocularis	thymidylate kinase	0.007	0.0493	0.1836
Echinococcus multilocularis	lamin	0.0026	0.0134	0.05
Entamoeba histolytica	pyrophosphate-dependent phosphofructokinase	0.0029	0.0153	0.0368
Schistosoma mansoni	phosphoglucomutase	0.0065	0.0445	0.0445
Schistosoma mansoni	6-phosphofructokinase	0.0106	0.0786	0.0786
Trypanosoma brucei	dihydrolipoamide dehydrogenase, point mutation	0.0016	0.005	0.0102
Trypanosoma cruzi	thymidylate kinase, putative	0.007	0.0493	0.1242
Loa Loa (eye worm)	6-phosphofructokinase	0.0106	0.0786	0.4306
Onchocerca volvulus	Ribonuclease H1 homolog	0.0065	0.0445	0.9029
Leishmania major	thymidine kinase, putative	0.0489	0.3897	1
Schistosoma mansoni	dihydrolipoamide dehydrogenase	0.0016	0.005	0.005
Schistosoma mansoni	ap endonuclease	0.0018	0.0069	0.0069
Echinococcus granulosus	intermediate filament protein	0.0026	0.0134	0.05
Trypanosoma cruzi	thymidine kinase, putative	0.0489	0.3897	1
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0026	0.0134	0.0736
Leishmania major	2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein	0.0016	0.005	0.0102
Chlamydia trachomatis	fructose-6-phosphate phosphotransferase	0.0029	0.0153	0.2335
Trypanosoma cruzi	thymidylate kinase, putative	0.007	0.0493	0.1242
Leishmania major	ATP-dependent phosphofructokinase	0.0106	0.0786	0.1995
Brugia malayi	intermediate filament protein	0.0026	0.0134	0.0736
Trypanosoma brucei	dihydrolipoyl dehydrogenase	0.0016	0.005	0.0102
Plasmodium vivax	dihydrolipoyl dehydrogenase, apicoplast, putative	0.0016	0.005	0.034
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	0.0018	0.0069	0.005
Echinococcus multilocularis	musashi	0.0026	0.0134	0.05
Mycobacterium tuberculosis	Thymidylate kinase Tmk (dTMP kinase) (thymidylic acid kinase) (TMPK)	0.007	0.0493	0.5371
Loa Loa (eye worm)	intermediate filament protein	0.0026	0.0134	0.0736
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0046	0.0296	0.2985
Trichomonas vaginalis	phosphofructokinase, putative	0.0106	0.0786	0.1995
Trypanosoma brucei	trypanothione reductase	0.0046	0.0296	0.0736
Leishmania major	hypothetical protein, conserved	0.0028	0.0145	0.0345
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0117	0.0875	1
Brugia malayi	cytoplasmic intermediate filament protein	0.0014	0.0035	0.019
Brugia malayi	RNase H family protein	0.0065	0.0445	0.244
Entamoeba histolytica	phosphofructokinase, putative	0.0106	0.0786	0.1995
Plasmodium falciparum	ATP-dependent 6-phosphofructokinase	0.0029	0.0153	0.2335
Echinococcus granulosus	cytoplasmic intermediate filament protein	0.0013	0.0023	0.0086
Trypanosoma brucei	retrotransposon hot spot protein 4 (RHS4), interrupted	0.0073	0.0515	0.1298
Brugia malayi	RNase H family protein	0.0065	0.0445	0.244
Giardia lamblia	CDC8	0.007	0.0493	0.1151
Toxoplasma gondii	phosphofructokinase PFKII	0.0029	0.0153	0.2618
Trichomonas vaginalis	phosphofructokinase, putative	0.0029	0.0153	0.0368
Brugia malayi	Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein	0.0012	0.0015	0.0084
Trypanosoma brucei	ingi protein (ORF1)	0.0073	0.0515	0.1298
Chlamydia trachomatis	thymidylate kinase	0.007	0.0493	1
Trypanosoma cruzi	ribonuclease H1, putative	0.0065	0.0445	0.1119
Schistosoma mansoni	hypothetical protein	0.007	0.0493	0.0493
Entamoeba histolytica	Thymidylate kinase, putative	0.007	0.0493	0.1242
Echinococcus granulosus	geminin	0.034	0.2685	1
Onchocerca volvulus	Putative thymidylate kinase	0.007	0.0493	1
Trichomonas vaginalis	mercuric reductase, putative	0.0016	0.005	0.0102
Trichomonas vaginalis	glutathione reductase, putative	0.0016	0.005	0.0102
Brugia malayi	Thioredoxin reductase	0.0046	0.0296	0.1624
Trypanosoma brucei	ingi protein (ORF1)	0.0073	0.0515	0.1298
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0046	0.0296	0.1103
Mycobacterium ulcerans	thymidylate kinase	0.007	0.0493	0.6022
Brugia malayi	phosphofructokinase	0.0106	0.0786	0.4306
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0018	0.0069	0.0436
Toxoplasma gondii	NADPH-glutathione reductase	0.0016	0.005	0.0369
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	0.0018	0.0069	0.0262
Toxoplasma gondii	6-phosphofructokinase	0.0029	0.0153	0.2618
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0106	0.0779	0.8837
Schistosoma mansoni	thymidylate kinase	0.007	0.0493	0.0493
Schistosoma mansoni	lamin	0.0026	0.0134	0.0134
Trichomonas vaginalis	phosphofructokinase, putative	0.0029	0.0153	0.0368
Entamoeba histolytica	phosphofructokinase, putative	0.0106	0.0786	0.1995
Brugia malayi	glutathione reductase	0.0046	0.0296	0.1624
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0016	0.005	0.0102

Activities

Activity type	Activity value	Assay description	Source	Reference
EC50 (functional)	= 7.4 nM	Agonist activity at human GPR119 by melanophore assay	ChEMBL.	21444206
EC50 (functional)	= 42 nM	Agonist activity at rat GPR119 by melanophore assay	ChEMBL.	21444206
Emax (functional)	= 103 %	Agonist activity at human GPR119 by melanophore assay relative to AR231453	ChEMBL.	21444206
Ratio EC50 (binding)	= 3	Selectivity ratio of EC50 for rat GPR119 to EC50 for human GPR119	ChEMBL.	21444206

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: CHEMBL1773291

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 1509074