TDR Targets

Basic information

Technical information

TDR Targets ID: 714010
Name: 7-(2-methoxyethyl)-3-methyl-8-phenylsulfanylp urine-2,6-dione
MW: 332.378 | Formula: C15H16N4O3S
H donors: 1 H acceptors: 3 LogP: 1.57 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: COCCn1c(Sc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C
InChi: 1S/C15H16N4O3S/c1-18-12-11(13(20)17-14(18)21)19(8-9-22-2)15(16-12)23-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3,(H,17,20,21)
InChiKey: NOTJZVQLRMNYII-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

7-(2-methoxyethyl)-3-methyl-8-phenylsulfanyl-purine-2,6-dione
7-(2-methoxyethyl)-3-methyl-8-(phenylthio)purine-2,6-dione
7-(2-methoxyethyl)-3-methyl-8-(phenylthio)xanthine
MLS000083991
SMR000047183
STOCK5S-26814
ZINC02444148

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	GNAS complex locus	Starlite/ChEMBL	No references
Homo sapiens	mitogen-activated protein kinase 1	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Toxoplasma gondii	CMGC kinase, MAPK family (ERK) MAPK-1	Get druggable targets OG5_126781	All targets in OG5_126781
Schistosoma japonicum	Mitogen-activated protein kinase 3, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Trypanosoma congolense	tyrosine protein kinase, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Trypanosoma cruzi	mitogen activated protein kinase 2, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Candida albicans	MAP kinase-like orf	Get druggable targets OG5_126781	All targets in OG5_126781
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Candida albicans	Serine/threonine protein kinase of MAP kinase family	Get druggable targets OG5_126781	All targets in OG5_126781
Trypanosoma brucei	mitogen activated protein kinase 4, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Leishmania infantum	mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440	Get druggable targets OG5_126781	All targets in OG5_126781
Trichomonas vaginalis	CMGC family protein kinase	Get druggable targets OG5_126781	All targets in OG5_126781
Leishmania infantum	mitogen activated protein kinase, putative,map kinase, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Echinococcus multilocularis	mitogen activated protein kinase 3	Get druggable targets OG5_126781	All targets in OG5_126781
Schistosoma japonicum	ko:K04371 extracellular signal-regulated kinase 1/2, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Schistosoma japonicum	ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus multilocularis	mitogen activated protein kinase	Get druggable targets OG5_126781	All targets in OG5_126781
Loa Loa (eye worm)	CMGC/MAPK/ERK1 protein kinase	Get druggable targets OG5_126781	All targets in OG5_126781
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma japonicum	Mitogen-activated protein kinase 3, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Leishmania braziliensis	mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440,map kinase	Get druggable targets OG5_126781	All targets in OG5_126781
Leishmania major	mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440	Get druggable targets OG5_126781	All targets in OG5_126781
Candida albicans	MAP kinase implicated in PKC1-controlled signalling pathway	Get druggable targets OG5_126781	All targets in OG5_126781
Leishmania donovani	mitogen-activated protein kinase 4	Get druggable targets OG5_126781	All targets in OG5_126781
Leishmania donovani	mitogen activated protein kinase, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Trichomonas vaginalis	CMGC family protein kinase	Get druggable targets OG5_126781	All targets in OG5_126781
Trichomonas vaginalis	CMGC family protein kinase	Get druggable targets OG5_126781	All targets in OG5_126781
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Echinococcus granulosus	mitogen activated protein kinase 3	Get druggable targets OG5_126781	All targets in OG5_126781
Trypanosoma cruzi	mitogen activated protein kinase 4, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Trypanosoma brucei	protein kinase, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Giardia lamblia	Kinase, CMGC MAPK	Get druggable targets OG5_126781	All targets in OG5_126781
Candida albicans	Serine/threonine protein kinase of MAP kinase family	Get druggable targets OG5_126781	All targets in OG5_126781
Candida albicans	MAP kinase-like orf	Get druggable targets OG5_126781	All targets in OG5_126781
Leishmania mexicana	mitogen activated protein kinase, putative,map kinase, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	Get druggable targets OG5_131088	All targets in OG5_131088
Trypanosoma brucei gambiense	mitogen-activated protein kinase, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Brugia malayi	MAP kinase sur-1	Get druggable targets OG5_126781	All targets in OG5_126781
Cryptosporidium hominis	MAPK	Get druggable targets OG5_126781	All targets in OG5_126781
Trypanosoma brucei gambiense	protein kinase, putative,tyrosine protein kinase, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Echinococcus granulosus	mitogen activated protein kinase	Get druggable targets OG5_126781	All targets in OG5_126781
Schistosoma mansoni	serine/threonine protein kinase	Get druggable targets OG5_126781	All targets in OG5_126781
Leishmania mexicana	mitogen-activated protein kinase	Get druggable targets OG5_126781	All targets in OG5_126781
Leishmania major	mitogen activated protein kinase, putative,map kinase, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Leishmania braziliensis	mitogen activated protein kinase, putative,map kinase, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Cryptosporidium parvum	MAPK, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Trichomonas vaginalis	CMGC family protein kinase	Get druggable targets OG5_126781	All targets in OG5_126781
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Trypanosoma brucei	mitogen-activated protein kinase 5	mitogen-activated protein kinase 1	360 aa	361 aa	33.2 %
Schistosoma mansoni	GTP-binding protein alpha subunit gna	GNAS complex locus	394 aa	450 aa	28.7 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0032	0.0457	0.1084
Schistosoma mansoni	protein kinase	0.0032	0.0457	0.1084
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0453	0.3582
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0042	0.0199
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type 1	0.0032	0.0457	0.1084
Trypanosoma cruzi	prolyl-tRNA synthetase, putative	0.0036	0.0549	0.4327
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0032	0.0453	0.3582
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	0.0063	0.1213	1
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0051	0.0927	0.425
Plasmodium vivax	calcium-dependent protein kinase 3, putative	0.0032	0.0457	0.0417
Giardia lamblia	Lysyl-tRNA synthetase	0.0023	0.0242	0.1709
Echinococcus granulosus	dna polymerase eta	0.002	0.0176	0.035
Trypanosoma cruzi	DNA polymerase eta, putative	0.002	0.0176	0.1143
Trypanosoma cruzi	mitogen activated protein kinase 2, putative	0.0063	0.1213	1
Plasmodium vivax	ATP synthase subunit gamma, mitochondrial, putative	0.0015	0.0068	0.0025
Brugia malayi	ATP synthase alpha chain, mitochondrial precursor, putative	0.0034	0.0518	0.2285
Mycobacterium tuberculosis	Probable ATP synthase alpha chain AtpA	0.0034	0.0518	1
Echinococcus multilocularis	solute carrier family 2, facilitated glucose	0.0102	0.2125	0.5443
Plasmodium falciparum	mitochondrial ATP synthase F1, epsilon subunit, putative	0.0044	0.076	0.0721
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0042	0.0199
Loa Loa (eye worm)	calcium/calmodulin-dependent protein kinase ID	0.0032	0.0457	0.215
Giardia lamblia	Prolyl-tRNA synthetase	0.0031	0.0429	0.3298
Trichomonas vaginalis	CMGC family protein kinase	0.0063	0.1213	0.5623
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0102	0.2125	0.5443
Mycobacterium ulcerans	F0F1 ATP synthase subunit gamma	0.0015	0.0068	0.0533
Trypanosoma cruzi	ATP synthase F1 subunit gamma protein, putative	0.0015	0.0068	0.0217
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0102	0.2125	0.5443
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0042	0.0199
Trypanosoma cruzi	lysyl-tRNA synthetase, putative	0.0023	0.0242	0.1709
Brugia malayi	Latrophilin receptor protein 2	0.0016	0.0089	0.0226
Mycobacterium tuberculosis	Lysyl-tRNA synthetase 2 LysX	0.0019	0.0161	0.2493
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0032	0.0453	0.3582
Plasmodium falciparum	calcium-dependent protein kinase 3	0.0032	0.0457	0.0417
Schistosoma mansoni	ATP synthase gamma subunit	0.0015	0.0068	0.0066
Trypanosoma brucei	ATP synthase F1, alpha subunit	0.0028	0.0374	0.291
Mycobacterium tuberculosis	Lysyl-tRNA synthetase 1 LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase)	0.0019	0.0161	0.2493
Wolbachia endosymbiont of Brugia malayi	ATP synthase F0F1 subunit epsilon	0.0019	0.0147	0.2196
Trypanosoma brucei	mitogen activated protein kinase 4, putative	0.0063	0.1213	1
Schistosoma mansoni	hypothetical protein	0.0175	0.3868	1
Trypanosoma brucei	glucose transporter 2A	0.0032	0.0453	0.3582
Loa Loa (eye worm)	ATP synthase subunit epsilon	0.0044	0.076	0.3578
Schistosoma mansoni	glucose transport protein	0.0102	0.2125	0.5443
Trypanosoma brucei	bifunctional aminoacyl-tRNA synthetase, putative	0.0036	0.0549	0.4391
Schistosoma mansoni	terminal deoxycytidyl transferase	0.002	0.0176	0.035
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0176	0.1243
Leishmania major	glucose transporter, lmgt3	0.0032	0.0453	0.3508
Trypanosoma brucei	calcium/calmodulin-dependent protein kinase, putative	0.0032	0.0457	0.3613
Leishmania major	hypothetical protein, conserved	0.0015	0.0061	0.0161
Toxoplasma gondii	prolyl-tRNA synthetase (ProRS)	0.0036	0.0549	0.0777
Toxoplasma gondii	calcium-dependent protein kinase CDPK2A	0.0032	0.0457	0.0637
Giardia lamblia	DINP protein human, muc B family	0.002	0.0176	0.1143
Chlamydia trachomatis	lysine--tRNA ligase	0.0023	0.0242	0.5
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0176	0.1243
Schistosoma mansoni	hypothetical protein	0.0044	0.076	0.1876
Entamoeba histolytica	protein kinase, putative	0.0032	0.0457	1
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0102	0.2125	0.5443
Schistosoma mansoni	serine/threonine protein kinase	0.0032	0.0457	0.1084
Leishmania major	ATP synthase, epsilon chain, putative	0.0019	0.0147	0.0892
Trypanosoma cruzi	hexose transporter	0.0032	0.0453	0.3508
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0051	0.0927	0.425
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0453	0.3582
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0927	0.4365
Schistosoma mansoni	protein kinase	0.0032	0.0457	0.1084
Plasmodium vivax	hexose transporter	0.0102	0.2125	0.2091
Toxoplasma gondii	ATP synthase, putative	0.0019	0.0147	0.016
Trypanosoma cruzi	mitogen activated protein kinase 4, putative	0.0063	0.1213	1
Trichomonas vaginalis	conserved hypothetical protein	0.0032	0.0453	0.1973
Trypanosoma cruzi	Mitochondrial ATP synthase epsilon chain, putative	0.0015	0.0061	0.0161
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0176	0.1243
Brugia malayi	lysyl-tRNA synthetase	0.0023	0.0242	0.0961
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0016	0.0089	0.0421
Plasmodium falciparum	mitogen-activated protein kinase 2	0.0165	0.3631	0.3604
Loa Loa (eye worm)	sugar transporter	0.0102	0.2125	1
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0042	0.0199
Echinococcus multilocularis	mitochondrial F1F0 ATP synthase subunit epsilon	0.0044	0.076	0.1876
Trichomonas vaginalis	CMGC family protein kinase	0.0063	0.1213	0.5623
Trypanosoma cruzi	hexose transporter, putative	0.0017	0.0112	0.0598
Brugia malayi	MAP kinase sur-1	0.0063	0.1213	0.5623
Echinococcus granulosus	lysyl tRNA synthetase	0.0023	0.0242	0.0523
Trypanosoma brucei	myo-inositol/proton symporter (MIT)	0.0014	0.0042	0.0114
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0089	0.0421
Loa Loa (eye worm)	CMGC/MAPK/ERK1 protein kinase	0.0063	0.1213	0.5711
Plasmodium vivax	mitogen-activated protein kinase 2, putative	0.0165	0.3631	0.3604
Toxoplasma gondii	protein kinase, putative	0.0288	0.6562	1
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	0.0063	0.1213	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.1017	0.2548
Trichomonas vaginalis	DNA polymerase eta, putative	0.002	0.0176	0.0643
Mycobacterium ulcerans	DNA polymerase IV	0.002	0.0176	0.2812
Mycobacterium tuberculosis	Probable ATP synthase epsilon chain AtpC	0.0019	0.0147	0.2196
Echinococcus multilocularis	mitogen activated protein kinase	0.0063	0.1213	0.3061
Schistosoma mansoni	glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs)	0.0031	0.0429	0.101
Brugia malayi	ATP synthase epsilon chain, mitochondrial	0.0044	0.076	0.3447
Echinococcus multilocularis	ATP synthase subunit delta, mitochondrial	0.0019	0.0147	0.0273
Brugia malayi	Calcium/calmodulin-dependent protein kinase type II alpha chain	0.0032	0.0457	0.1991
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0453	0.3582
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0016	0.0089	0.0226
Schistosoma mansoni	DNA polymerase eta	0.002	0.0176	0.035
Trypanosoma brucei	DNA polymerase IV, putative	0.002	0.0176	0.1243
Trichomonas vaginalis	lysyl-tRNA synthetase, putative	0.0023	0.0242	0.0961
Brugia malayi	ImpB/MucB/SamB family protein	0.002	0.0176	0.0643
Leishmania major	glucose transporter, lmgt2	0.0032	0.0453	0.3508
Plasmodium vivax	calcium-dependent protein kinase 4, putative	0.0032	0.0457	0.0417
Brugia malayi	ImpB/MucB/SamB family protein	0.002	0.0176	0.0643
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0453	0.3582
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0042	0.0199
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0042	0.0199
Trichomonas vaginalis	prolyl-tRNA synthetase, putative	0.0031	0.0429	0.1855
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0176	0.1243
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0102	0.2125	0.5443
Plasmodium vivax	ATP synthase alpha chain, putative	0.0034	0.0518	0.0478
Leishmania major	prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative	0.0036	0.0549	0.4327
Plasmodium falciparum	calcium-dependent protein kinase 4	0.0032	0.0457	0.0417
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0032	0.0453	0.3582
Leishmania major	protein kinase, putative	0.0032	0.0457	0.354
Onchocerca volvulus	ATP synthase subunit gamma, mitochondrial homolog	0.0015	0.0068	0.0533
Schistosoma mansoni	lysyl-tRNA synthetase	0.0023	0.0242	0.0523
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0453	0.3582
Plasmodium falciparum	calcium-dependent protein kinase 1	0.0032	0.0457	0.0417
Plasmodium falciparum	calcium-dependent protein kinase 2	0.0032	0.0457	0.0417
Plasmodium vivax	hypothetical protein, conserved	0.0019	0.0147	0.0105
Trypanosoma cruzi	DNA polymerase kappa, putative	0.002	0.0176	0.1143
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0453	0.3582
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0042	0.0199
Trichomonas vaginalis	CAMK family protein kinase	0.0032	0.0457	0.1991
Trypanosoma brucei	sugar transporter, putative	0.0014	0.0042	0.0114
Trypanosoma cruzi	ATP synthase F1 subunit gamma protein, putative	0.0015	0.0068	0.0217
Trypanosoma cruzi	Mitochondrial ATP synthase epsilon chain, putative	0.0015	0.0061	0.0161
Echinococcus multilocularis	dna polymerase kappa	0.002	0.0176	0.035
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0042	0.0199
Trypanosoma brucei	ATP synthase F1, alpha subunit	0.0028	0.0374	0.291
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0176	0.1243
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.1017	0.2548
Trypanosoma brucei	mitochondrial ATP synthase delta chain	0.0019	0.0147	0.0996
Onchocerca volvulus	ATP synthase subunit delta, mitochondrial homolog	0.0019	0.0147	0.2196
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0055	0.1017	0.4787
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0032	0.0457	0.1084
Echinococcus granulosus	5'partial\|ATP synthase subunit delta mitochondrial	0.0019	0.0147	0.0273
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0292	0.1375
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0016	0.0089	0.0123
Echinococcus multilocularis	GPCR, family 2	0.0016	0.0089	0.0123
Entamoeba histolytica	prolyl-tRNA synthetase, putative	0.0031	0.0429	0.8993
Mycobacterium leprae	Probable prolyl tRNA synthetase ProS	0.0031	0.0429	0.8011
Schistosoma mansoni	hypothetical protein	0.0035	0.054	0.13
Trypanosoma brucei	DNA polymerase eta, putative	0.002	0.0176	0.1243
Trypanosoma cruzi	hexose transporter, putative	0.0032	0.0453	0.3508
Trichomonas vaginalis	sugar transporter, putative	0.0032	0.0453	0.1973
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.002	0.0176	0.0829
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0055	0.1017	0.4681
Leishmania major	lysyl-tRNA synthetase, putative	0.0023	0.0242	0.1709
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.1017	0.2548
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0042	0.0199
Trypanosoma brucei	glucose transporter 1E	0.0032	0.0453	0.3582
Trichomonas vaginalis	CMGC family protein kinase	0.0063	0.1213	0.5623
Plasmodium falciparum	hexose transporter	0.0102	0.2125	0.2091
Wolbachia endosymbiont of Brugia malayi	ATP synthase F0F1 subunit gamma	0.0015	0.0068	0.0533
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0176	0.1243
Mycobacterium leprae	PROBABLE ATP SYNTHASE EPSILON CHAIN ATPC	0.0019	0.0147	0.1757
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0176	0.1243
Echinococcus multilocularis	lysyl tRNA synthetase	0.0023	0.0242	0.0523
Loa Loa (eye worm)	CAMK/CAMK2 protein kinase	0.0032	0.0457	0.215
Trichomonas vaginalis	CMGC family protein kinase	0.0063	0.1213	0.5623
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0051	0.0927	0.4365
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0176	0.1243
Plasmodium vivax	ATP synthase epsilon chain, mitochondrial , putative	0.0044	0.076	0.0721
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0457	0.215
Schistosoma mansoni	hypothetical protein	0.0016	0.0089	0.0123
Plasmodium falciparum	calcium-dependent protein kinase 5	0.0032	0.0457	0.0417
Mycobacterium tuberculosis	Probable ATP synthase gamma chain AtpG	0.0015	0.0068	0.0533
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0042	0.0199
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0032	0.0457	0.1084
Schistosoma mansoni	hypothetical protein	0.0016	0.0089	0.0123
Leishmania major	mitogen activated protein kinase, putative,map kinase, putative	0.0063	0.1213	1
Leishmania major	DNA polymerase eta, putative	0.002	0.0176	0.1143
Echinococcus multilocularis	ATP synthase gamma subunit	0.0015	0.0068	0.0066
Toxoplasma gondii	CMGC kinase, MAPK family (ERK) MAPK-1	0.0063	0.1213	0.1796
Entamoeba histolytica	protein kinase, putative	0.0032	0.0457	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.1017	0.2548
Schistosoma mansoni	serine/threonine protein kinase	0.0063	0.1213	0.3061
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0032	0.0457	0.1084
Trichomonas vaginalis	conserved hypothetical protein	0.0032	0.0453	0.1973
Schistosoma mansoni	hypothetical protein	0.0016	0.0089	0.0123
Schistosoma mansoni	ATP synthase gamma subunit	0.0015	0.0068	0.0066
Leishmania major	mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440	0.0063	0.1213	1
Echinococcus granulosus	ATP synthase subunit alpha mitochondrial	0.0034	0.0518	0.1244
Echinococcus granulosus	glutamyl tRNA synthetase cytoplasmic	0.0031	0.0429	0.101
Schistosoma mansoni	glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs)	0.0031	0.0429	0.101
Loa Loa (eye worm)	hypothetical protein	0.002	0.0176	0.0829
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.002	0.0176	0.2812
Echinococcus granulosus	mitogen activated protein kinase	0.0063	0.1213	0.3061
Mycobacterium leprae	PROBABLE ATP SYNTHASE ALPHA CHAIN ATPA	0.0034	0.0518	1
Echinococcus granulosus	mitogen activated protein kinase 3	0.0063	0.1213	0.3061
Echinococcus granulosus	geminin	0.0175	0.3868	1
Leishmania major	prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative	0.0036	0.0549	0.4327
Echinococcus granulosus	calcium dependent protein kinase	0.0029	0.0398	0.0929
Trichomonas vaginalis	glucose transporter, putative	0.0032	0.0453	0.1973
Plasmodium falciparum	ATP synthase subunit delta, mitochondrial, putative	0.0019	0.0147	0.0105
Trypanosoma cruzi	DNA polymerase kappa, putative	0.002	0.0176	0.1143
Plasmodium falciparum	proline--tRNA ligase	0.0036	0.0549	0.0509
Toxoplasma gondii	ATP synthase F1 gamma subunit	0.0015	0.0068	0.0039
Echinococcus granulosus	ATP synthase gamma subunit	0.0015	0.0068	0.0066
Leishmania major	glucose transporter, lmgt1	0.0032	0.0453	0.3508
Schistosoma mansoni	glucose transport protein	0.0102	0.2125	0.5443
Trypanosoma brucei	ATP synthase F1 subunit gamma protein, putative	0.0015	0.0068	0.0328
Plasmodium falciparum	protein kinase 7	0.0288	0.6562	0.6547
Mycobacterium leprae	PROBABLE ATP SYNTHASE BETA CHAIN ATPD	0.0034	0.0518	1
Toxoplasma gondii	calcium-dependent protein kinase CDPK3	0.0032	0.0457	0.0637
Schistosoma mansoni	ATP synthase delta chain mitochondrial	0.0019	0.0147	0.0273
Plasmodium vivax	lysine--tRNA ligase, putative	0.0023	0.0242	0.0201
Trypanosoma brucei	protein kinase, putative	0.0063	0.1213	1
Plasmodium vivax	proline--tRNA ligase, putative	0.0036	0.0549	0.0509
Leishmania major	ATPase alpha subunit	0.0028	0.0374	0.2829
Echinococcus granulosus	GPCR family 2	0.0016	0.0089	0.0123
Loa Loa (eye worm)	major facilitator superfamily transporter	0.0014	0.0042	0.0199
Loa Loa (eye worm)	sugar transporter	0.0014	0.0042	0.0199
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0176	0.1243
Toxoplasma gondii	calcium-dependent protein kinase CDPK2B	0.0032	0.0457	0.0637
Schistosoma mansoni	hypothetical protein	0.0102	0.2125	0.5443
Trichomonas vaginalis	lysyl-tRNA synthetase, putative	0.002	0.0176	0.0641
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0042	0.0199
Trypanosoma cruzi	DNA polymerase kappa, putative	0.002	0.0176	0.1143
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0032	0.0457	0.1084
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0032	0.0457	0.1084
Plasmodium vivax	calcium-dependent protein kinase 1, putative	0.0032	0.0457	0.0417
Toxoplasma gondii	cell-cycle-associated protein kinase MAPK, putative	0.0165	0.3631	0.5504
Entamoeba histolytica	hypothetical protein	0.0023	0.0242	0.2363
Plasmodium vivax	calcium-dependent protein kinase, putative	0.0032	0.0457	0.0417
Echinococcus multilocularis	glutamyl tRNA synthetase cytoplasmic	0.0031	0.0429	0.101
Brugia malayi	Sugar transporter family protein	0.0102	0.2125	1
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0242	0.1141
Schistosoma mansoni	hypothetical protein	0.0016	0.0089	0.0123
Echinococcus granulosus	General substrate transporter	0.0087	0.1784	0.4553
Echinococcus multilocularis	geminin	0.0175	0.3868	1
Trypanosoma brucei	mitochondrial ATP synthase epsilon chain	0.0015	0.0061	0.0272
Echinococcus granulosus	mitochondrial F1F0 ATP synthase subunit epsilon	0.0044	0.076	0.1876
Plasmodium falciparum	ATP synthase F1, alpha subunit	0.0034	0.0518	0.0478
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.002	0.0176	0.035
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0453	0.3582
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.002	0.0176	0.035
Trichomonas vaginalis	sugar transporter, putative	0.0032	0.0453	0.1973
Schistosoma mansoni	ATP synthase gamma subunit	0.0015	0.0068	0.0066
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0429	0.2017
Echinococcus multilocularis	mitogen activated protein kinase 3	0.0063	0.1213	0.3061
Giardia lamblia	Kinase, CMGC MAPK	0.0063	0.1213	1
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.1017	0.2548
Toxoplasma gondii	lysine-tRNA ligase	0.0023	0.0242	0.0307
Brugia malayi	Cam kinase protein 1	0.0032	0.0457	0.1991
Schistosoma mansoni	ATP synthase gamma subunit	0.0015	0.0068	0.0066
Schistosoma mansoni	lysyl-tRNA synthetase	0.0023	0.0242	0.0523
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0032	0.0457	0.1084
Toxoplasma gondii	atp synthase F1, epsilon subunit, putative	0.0044	0.076	0.1101
Echinococcus multilocularis	calcium dependent protein kinase	0.0029	0.0398	0.0929
Plasmodium falciparum	lysine--tRNA ligase	0.0023	0.0242	0.0201
Leishmania major	DNA polymerase kappa, putative	0.002	0.0176	0.1143
Brugia malayi	ATP synthase gamma chain, mitochondrial precursor, putative	0.0015	0.0068	0.0122
Schistosoma mansoni	protein kinase	0.0032	0.0457	0.1084
Mycobacterium tuberculosis	Probable ATP synthase beta chain AtpD	0.0034	0.0518	1
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0453	0.3582
Onchocerca volvulus	ATP synthase subunit alpha, mitochondrial homolog	0.0034	0.0518	1
Schistosoma mansoni	ATP synthase alpha subunit mitochondrial	0.0034	0.0518	0.1244
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0068	0.0318
Mycobacterium ulcerans	lysyl-tRNA synthetase	0.0023	0.0242	0.4206
Mycobacterium ulcerans	F0F1 ATP synthase subunit alpha	0.0034	0.0518	1
Trypanosoma brucei	DNA polymerase IV, putative	0.002	0.0176	0.1243
Toxoplasma gondii	facilitative glucose transporter GT1	0.0102	0.2125	0.3195
Trichomonas vaginalis	glucose transporter, putative	0.0032	0.0453	0.1973
Loa Loa (eye worm)	hypothetical protein	0.0035	0.054	0.2539
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0429	0.2017
Mycobacterium leprae	Possible lysyl-tRNA synthetase 2 LysX	0.0023	0.0242	0.388
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0016	0.0089	0.0123
Loa Loa (eye worm)	ATP synthase subunit delta	0.0019	0.0147	0.0691
Schistosoma mansoni	ATP synthase gamma subunit	0.0015	0.0068	0.0066
Mycobacterium tuberculosis	Conserved hypothetical protein	0.002	0.0176	0.2812
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0102	0.2125	0.5443
Mycobacterium ulcerans	lysyl-tRNA synthetase	0.0023	0.0242	0.4206
Wolbachia endosymbiont of Brugia malayi	ATP synthase F0F1 subunit alpha	0.0034	0.0518	1
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.002	0.0176	0.035
Schistosoma mansoni	hypothetical protein	0.0175	0.3868	1
Trypanosoma cruzi	hexose transporter, putative	0.0032	0.0453	0.3508
Echinococcus granulosus	dna polymerase kappa	0.002	0.0176	0.035
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0176	0.1243
Trypanosoma cruzi	hexose transporter, putative	0.0032	0.0453	0.3508
Brugia malayi	Bifunctional aminoacyl-tRNA synthetase	0.0031	0.0429	0.1855
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0042	0.0199
Trypanosoma brucei	unspecified product	0.002	0.0176	0.1243
Trypanosoma brucei	lysyl-tRNA synthetase, putative	0.0023	0.0242	0.1803
Loa Loa (eye worm)	major facilitator superfamily transporter	0.0014	0.0042	0.0199
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0042	0.0199
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0102	0.2125	0.5443
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.002	0.0176	0.1143
Brugia malayi	bifunctional aminoacyl-tRNA synthetase	0.0031	0.0429	0.1855
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0042	0.0199
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0042	0.0199
Trypanosoma cruzi	prolyl-tRNA synthetase, putative	0.0036	0.0549	0.4327
Brugia malayi	latrophilin 2 splice variant baaae	0.0035	0.054	0.2388
Leishmania major	ATP synthase F1 subunit gamma protein, putative	0.0015	0.0068	0.0217
Echinococcus multilocularis	ATP synthase subunit alpha, mitochondrial	0.0034	0.0518	0.1244
Brugia malayi	ATP synthase delta chain, mitochondrial precursor, putative	0.0019	0.0147	0.0502
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.1017	0.2548
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.1017	0.2548
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0102	0.2125	0.5443
Trypanosoma brucei	DNA polymerase IV, putative	0.002	0.0176	0.1243
Plasmodium falciparum	ATP synthase subunit gamma, mitochondrial	0.0015	0.0068	0.0025
Trichomonas vaginalis	conserved hypothetical protein	0.0102	0.2125	1
Mycobacterium leprae	Probable lysyl-tRNA synthase LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase)	0.0019	0.0161	0.207
Echinococcus multilocularis	dna polymerase eta	0.002	0.0176	0.035
Trypanosoma cruzi	DNA polymerase kappa, putative	0.002	0.0176	0.1143
Echinococcus multilocularis	General substrate transporter	0.0087	0.1784	0.4553
Mycobacterium ulcerans	DNA polymerase IV	0.002	0.0176	0.2812
Plasmodium vivax	CDK-related protein kinase 6, putative	0.0432	1	1
Leishmania major	ATPase alpha subunit	0.0028	0.0374	0.2829
Trichomonas vaginalis	sugar transporter, putative	0.0032	0.0453	0.1973
Leishmania major	glucose transporter/membrane transporter D2, putative	0.0032	0.0453	0.3508
Schistosoma mansoni	glucose transport protein	0.0102	0.2125	0.5443
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0016	0.0089	0.0123
Mycobacterium ulcerans	F0F1 ATP synthase subunit epsilon	0.0019	0.0147	0.2196
Trichomonas vaginalis	DNA polymerase IV / kappa, putative	0.002	0.0176	0.0643
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0016	0.0089	0.0123
Trypanosoma cruzi	ATP synthase, epsilon chain, putative	0.0019	0.0147	0.0892

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	0.0041 uM	PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference
Potency (functional)	= 1.2589 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of the ERK Signaling Pathway using a Homogeneous Screening Assay. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	17.7828 uM	PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 22.3872 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Influenza NS1 Protein Function. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 25.1189 um	PUBCHEM_BIOASSAY: qHTS Assay for Antagonists of the Neuropeptide S Receptor: cAMP Signal Transduction. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	28.1838 uM	PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 31.6228 um	PUBCHEM_BIOASSAY: qHTS Assay for Agonists of the Thyroid Stimulating Hormone Receptor. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 31.6228 um	PUBCHEM_BIOASSAY: qHTS Assay for Agonists of the Thyroid Stimulating Hormone Receptor: Activators of Intracellular cAMP Concentrations in Parental HEK 293. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	50.1187 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Mammalian Selenoprotein Thioredoxin Reductase 1 (TrxR1): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488771]	ChEMBL.	No reference
Potency (functional)	89.1251 uM	PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962]	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Plasmodium falciparum	ChEMBL23

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: CHEMBL1359463
Search by Saint Jude

Bibliographic References

No literature references available for this target.

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Detailed information for compound 714010