TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 306.314 | Formula: C15H18N2O5
H donors: 0 H acceptors: 2 LogP: 1.67 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: COC1C2CCN(c3c2c(N1C=O)c(OC)c(c3)OC)C=O
InChi: 1S/C15H18N2O5/c1-20-11-6-10-12-9(4-5-16(10)7-18)15(22-3)17(8-19)13(12)14(11)21-2/h6-9,15H,4-5H2,1-3H3
InChiKey: NZSGWLXZRUFFSJ-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

No synonyms found for this compound

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
Trypanosoma brucei	glucose transporter, putative	0.0139	0.0621	0.868
Echinococcus multilocularis	microtubule associated protein 2	0.0701	0.362	1
Plasmodium falciparum	protein kinase 7	0.1263	0.6617	0.6612
Trypanosoma brucei	glucose transporter, putative	0.0139	0.0621	0.868
Schistosoma mansoni	DEAD box ATP-dependent RNA helicase	0.0028	0.0031	0.0042
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0139	0.0621	0.868
Trypanosoma brucei	sugar transporter, putative	0.0063	0.0217	0.303
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Entamoeba histolytica	DEAD/DEAH box helicase, putative	0.0028	0.0031	0.0439
Schistosoma mansoni	glucose transport protein	0.0447	0.2266	0.6243
Echinococcus granulosus	microtubule associated protein 2	0.0701	0.362	1
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0032	0.0052	0.0213
Trypanosoma cruzi	hexose transporter, putative	0.0139	0.0621	0.868
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0139	0.0621	0.868
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0217	0.094
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Trypanosoma brucei	bifunctional aminoacyl-tRNA synthetase, putative	0.0156	0.0715	1
Schistosoma mansoni	hypothetical protein	0.0032	0.0052	0.0102
Toxoplasma gondii	threonyl-tRNA synthetase family protein	0.0025	0.0016	0.0024
Trichomonas vaginalis	conserved hypothetical protein	0.0063	0.0217	0.0956
Mycobacterium leprae	Probable threonyl-tRNA synthetase ThrS (threonine-tRNA synthetase) (ThrRS) (Threonine-tRNA ligase)	0.0025	0.0016	0.0262
Trypanosoma cruzi	prolyl-tRNA synthetase, putative	0.0156	0.0715	1
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0004	0.01
Echinococcus granulosus	lysyl tRNA synthetase	0.01	0.0414	0.1104
Schistosoma mansoni	cellular tumor antigen P53	0.0048	0.0137	0.0338
Echinococcus granulosus	solute carrier family 22	0.0063	0.0217	0.0558
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Plasmodium vivax	RNA helicase-1, putative	0.0028	0.0031	0.0015
Trypanosoma cruzi	hexose transporter, putative	0.0139	0.0621	0.868
Trypanosoma cruzi	threonyl-tRNA synthetase, putative	0.0025	0.0016	0.0218
Trichomonas vaginalis	conserved hypothetical protein	0.0447	0.2266	1
Loa Loa (eye worm)	hypothetical protein	0.0134	0.0597	0.262
Brugia malayi	major facilitator superfamily protein	0.0063	0.0217	0.094
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Leishmania major	glucose transporter, lmgt2	0.0139	0.0621	0.868
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0137	0.0611	0.1653
Mycobacterium ulcerans	sugar-transport integral membrane protein SugI	0.0063	0.0217	0.5239
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0137	0.0611	0.1653
Echinococcus granulosus	solute carrier family 22	0.0063	0.0217	0.0558
Trypanosoma brucei	lysyl-tRNA synthetase, putative	0.01	0.0414	0.5783
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0447	0.2266	0.6243
Mycobacterium tuberculosis	Lysyl-tRNA synthetase 2 LysX	0.0085	0.0333	1
Brugia malayi	Sugar transporter family protein	0.0063	0.0217	0.094
Schistosoma mansoni	sugar transporter	0.0063	0.0217	0.0558
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0101	0.0422	0.1846
Leishmania major	RNA helicase, putative,mitochondrial, putative	0.0038	0.0086	0.1207
Plasmodium falciparum	calcium-dependent protein kinase 5	0.0137	0.0612	0.0597
Onchocerca volvulus		0.0063	0.0217	1
Mycobacterium ulcerans	sugar transporter	0.0063	0.0217	0.5239
Onchocerca volvulus	Eukaryotic initiation factor 4A homolog	0.0028	0.0031	0.1256
Trypanosoma cruzi	hexose transporter, putative	0.0139	0.0621	0.868
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0447	0.2266	0.6243
Plasmodium falciparum	calcium-dependent protein kinase 3	0.0137	0.0612	0.0597
Trichomonas vaginalis	conserved hypothetical protein	0.0063	0.0217	0.0956
Trypanosoma brucei	glucose transporter, putative	0.0139	0.0621	0.868
Schistosoma mansoni	microtubule-associated protein tau	0.0701	0.362	1
Entamoeba histolytica	threonyl-tRNA synthetase, putative	0.0025	0.0016	0.0189
Loa Loa (eye worm)	hypothetical protein	0.0134	0.0597	0.262
Trichomonas vaginalis	threonyl-tRNA synthetase, putative	0.0025	0.0016	0.0069
Chlamydia trachomatis	proline--tRNA ligase	0.0047	0.0134	0.2978
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Schistosoma mansoni	sugar transporter	0.0063	0.0217	0.0558
Onchocerca volvulus		0.0063	0.0217	1
Echinococcus granulosus	eukaryotic initiation factor 4A	0.0028	0.0031	0.0042
Leishmania major	myo-inositol/proton symporter (MIT)	0.0063	0.0217	0.303
Toxoplasma gondii	transporter, major facilitator family protein	0.0063	0.0217	0.0327
Brugia malayi	bifunctional aminoacyl-tRNA synthetase	0.0134	0.0597	0.262
Giardia lamblia	Lysyl-tRNA synthetase	0.01	0.0414	0.6849
Treponema pallidum	ATP-dependent RNA helicase	0.0028	0.0031	0.1285
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0101	0.0422	0.1846
Onchocerca volvulus		0.0063	0.0217	1
Trypanosoma brucei	glucose transporter 2A	0.0139	0.0621	0.868
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0447	0.2266	0.6243
Trichomonas vaginalis	DEAD box ATP-dependent RNA helicase, putative	0.0028	0.0031	0.0136
Brugia malayi	Sugar transporter family protein	0.0447	0.2266	1
Entamoeba histolytica	hypothetical protein	0.0038	0.0085	0.1338
Trypanosoma cruzi	ATP-dependent RNA and DNA helicase, mitochondrial, putative	0.0038	0.0086	0.1207
Schistosoma mansoni	hypothetical protein	0.0032	0.0052	0.0102
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0137	0.0611	0.1653
Trypanosoma brucei	threonyl-tRNA synthetase, putative	0.0025	0.0016	0.0218
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0137	0.0611	0.1653
Plasmodium falciparum	hexose transporter	0.0447	0.2266	0.2253
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0023	0.0004	0.007
Plasmodium vivax	calcium-dependent protein kinase 3, putative	0.0137	0.0612	0.0597
Mycobacterium tuberculosis	Probable cold-shock DeaD-box protein A homolog DeaD (ATP-dependent RNA helicase dead homolog)	0.0028	0.0031	0.0925
Mycobacterium tuberculosis	Lysyl-tRNA synthetase 1 LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase)	0.0085	0.0333	1
Loa Loa (eye worm)	glycyl-tRNA synthetase	0.0025	0.0016	0.0051
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Schistosoma mansoni	sugar transporter	0.0063	0.0217	0.0558
Brugia malayi	glycyl-tRNA synthetase	0.0025	0.0016	0.0051
Echinococcus multilocularis	solute carrier family 22	0.0063	0.0217	0.0558
Leishmania major	prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative	0.0156	0.0715	1
Entamoeba histolytica	hypothetical protein	0.0038	0.0085	0.1338
Schistosoma mansoni	hypothetical protein	0.0032	0.0052	0.0102
Entamoeba histolytica	protein kinase, putative	0.0137	0.0611	1
Plasmodium vivax	calcium-dependent protein kinase, putative	0.0137	0.0612	0.0597
Loa Loa (eye worm)	hypothetical protein	0.0109	0.0463	0.2027
Echinococcus multilocularis	tumor protein p63	0.0328	0.163	0.4479
Leishmania major	glucose transporter, lmgt3	0.0139	0.0621	0.868
Trypanosoma brucei	calcium/calmodulin-dependent protein kinase, putative	0.0137	0.0611	0.855
Schistosoma mansoni	glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs)	0.0134	0.0597	0.1612
Schistosoma mansoni	serine/threonine protein kinase	0.0137	0.0611	0.1653
Trypanosoma cruzi	glucose transporter, putative	0.0063	0.0217	0.303
Loa Loa (eye worm)	major facilitator superfamily transporter	0.0063	0.0217	0.094
Leishmania major	prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative	0.0156	0.0715	1
Leishmania major	hypothetical protein, conserved	0.0063	0.0217	0.303
Schistosoma mansoni	lysyl-tRNA synthetase	0.01	0.0414	0.1104
Plasmodium vivax	ATP-dependent DEAD box helicase, putative	0.0038	0.0086	0.0071
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0031	0.0118
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0052	0.0213
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0004	0.01
Schistosoma mansoni	lysyl-tRNA synthetase	0.01	0.0414	0.1104
Leishmania major	glucose transporter/membrane transporter D2, putative	0.0139	0.0621	0.868
Brugia malayi	Calcium/calmodulin-dependent protein kinase type II alpha chain	0.0137	0.0611	0.2686
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0217	0.094
Loa Loa (eye worm)	hypothetical protein	0.0101	0.0422	0.1846
Toxoplasma gondii	sugar transporter ST1	0.0063	0.0217	0.0327
Loa Loa (eye worm)	hypothetical protein	0.0048	0.0137	0.0589
Brugia malayi	hypothetical protein	0.0063	0.0217	0.094
Toxoplasma gondii	eukaryotic initiation factor-4A, putative	0.0028	0.0031	0.0047
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0217	0.094
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0217	0.094
Trypanosoma brucei	glucose transporter, putative	0.0139	0.0621	0.868
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0101	0.0422	0.1846
Trichomonas vaginalis	glucose transporter, putative	0.0139	0.0621	0.274
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0217	0.094
Trichomonas vaginalis	conserved hypothetical protein	0.0139	0.0621	0.274
Schistosoma mansoni	hypothetical protein	0.0032	0.0052	0.0102
Echinococcus granulosus	calcium dependent protein kinase	0.0128	0.0566	0.1528
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0139	0.0621	0.868
Schistosoma mansoni	glucose transport protein	0.0447	0.2266	0.6243
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0023	0.0004	0.01
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Schistosoma mansoni	DEAD box ATP-dependent RNA helicase	0.0028	0.0031	0.0042
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Trichomonas vaginalis	conserved hypothetical protein	0.0063	0.0217	0.0956
Brugia malayi	hypothetical protein	0.0063	0.0217	0.094
Plasmodium vivax	calcium-dependent protein kinase 1, putative	0.0137	0.0612	0.0597
Loa Loa (eye worm)	hypothetical protein	0.01	0.0414	0.1811
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Mycobacterium tuberculosis	Probable dicarboxylic acid transport integral membrane protein KgtP (dicarboxylate transporter)	0.0063	0.0217	0.6499
Trypanosoma brucei	glucose transporter, putative	0.0139	0.0621	0.868
Plasmodium falciparum	lysine--tRNA ligase	0.01	0.0414	0.0399
Trichomonas vaginalis	conserved hypothetical protein	0.0063	0.0217	0.0956
Giardia lamblia	Sugar-proton symporter	0.0063	0.0217	0.346
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Schistosoma mansoni	hypothetical protein	0.0038	0.0085	0.0194
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0032	0.0052	0.0102
Trichomonas vaginalis	conserved hypothetical protein	0.0063	0.0217	0.0956
Brugia malayi	hypothetical protein	0.0063	0.0217	0.094
Onchocerca volvulus		0.0063	0.0217	1
Trichomonas vaginalis	glucose transporter, putative	0.0139	0.0621	0.274
Wolbachia endosymbiont of Brugia malayi	major facilitator superfamily permease	0.0063	0.0217	1
Plasmodium vivax	sugar transporter, putative	0.0063	0.0217	0.0201
Giardia lamblia	Prolyl-tRNA synthetase	0.0134	0.0597	1
Giardia lamblia	Translation initiation factor eIF-4A, putative	0.0028	0.0031	0.0262
Chlamydia trachomatis	lysine--tRNA ligase	0.01	0.0414	1
Echinococcus multilocularis	GPCR, family 2	0.0032	0.0052	0.0102
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	0.0004	0.0058
Toxoplasma gondii	lysine-tRNA ligase	0.01	0.0414	0.0625
Brugia malayi	lysyl-tRNA synthetase	0.01	0.0414	0.1811
Leishmania major	eukaryotic initiation factor 4a, putative	0.0028	0.0031	0.0431
Schistosoma mansoni	glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs)	0.0134	0.0597	0.1612
Toxoplasma gondii	hypothetical protein	0.0038	0.0086	0.013
Schistosoma mansoni	protein kinase	0.0137	0.0611	0.1653
Trichomonas vaginalis	glucose transporter, putative	0.0063	0.0217	0.0956
Mycobacterium leprae	Probable prolyl tRNA synthetase ProS	0.0134	0.0597	1
Mycobacterium leprae	Probable lysyl-tRNA synthase LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase)	0.0085	0.0333	0.5587
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0032	0.0052	0.0102
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Toxoplasma gondii	calcium-dependent protein kinase CDPK3	0.0137	0.0612	0.0925
Entamoeba histolytica	protein kinase, putative	0.0137	0.0611	1
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0447	0.2266	0.6243
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0217	0.094
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0217	0.094
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Onchocerca volvulus		0.0063	0.0217	1
Brugia malayi	Major Facilitator Superfamily protein	0.0063	0.0217	0.094
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0032	0.0052	0.0102
Echinococcus granulosus	glutamyl tRNA synthetase cytoplasmic	0.0134	0.0597	0.1612
Entamoeba histolytica	prolyl-tRNA synthetase, putative	0.0134	0.0597	0.9757
Trypanosoma cruzi	sugar transporter, putative	0.0063	0.0217	0.303
Echinococcus multilocularis	solute carrier family 22	0.0063	0.0217	0.0558
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0217	0.094
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Trypanosoma brucei	glucose transporter 1E	0.0139	0.0621	0.868
Onchocerca volvulus		0.0063	0.0217	1
Leishmania major	glucose transporter, lmgt1	0.0139	0.0621	0.868
Plasmodium falciparum	major facilitator superfamily domain-containing protein, putative	0.0063	0.0217	0.0201
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Echinococcus multilocularis	eukaryotic initiation factor 4A	0.0028	0.0031	0.0042
Trichomonas vaginalis	DEAD box ATP-dependent RNA helicase, putative	0.0028	0.0031	0.0136
Mycobacterium ulcerans	integral membrane transport protein	0.0063	0.0217	0.5239
Echinococcus granulosus	synaptic vesicle 2 protein	0.0063	0.0217	0.0558
Entamoeba histolytica	hypothetical protein	0.0038	0.0085	0.1338
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0137	0.0611	0.1653
Echinococcus granulosus	tumor protein p63	0.0328	0.163	0.4479
Toxoplasma gondii	cell-cycle-associated protein kinase MAPK, putative	0.0723	0.3734	0.5643
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type 1	0.0137	0.0611	0.1653
Onchocerca volvulus		0.0063	0.0217	1
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0447	0.2266	0.6243
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Trypanosoma cruzi	Eukaryotic initiation factor 4A-1	0.0028	0.0031	0.0431
Onchocerca volvulus		0.0063	0.0217	1
Plasmodium vivax	hexose transporter	0.0447	0.2266	0.2253
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0032	0.0052	0.0102
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Mycobacterium ulcerans	lysyl-tRNA synthetase	0.01	0.0414	1
Leishmania major	lysyl-tRNA synthetase, putative	0.01	0.0414	0.5783
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Brugia malayi	Latrophilin receptor protein 2	0.0032	0.0052	0.0213
Onchocerca volvulus	Putative transporter	0.0063	0.0217	1
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0023	0.0004	0.0124
Schistosoma mansoni	hypothetical protein	0.0069	0.0251	0.0652
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0023	0.0004	0.01
Schistosoma mansoni	glucose transport protein	0.0447	0.2266	0.6243
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	0.0004	0.0058
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Loa Loa (eye worm)	threonyl-tRNA synthetase	0.0025	0.0016	0.0051
Trichomonas vaginalis	DEAD box ATP-dependent RNA helicase, putative	0.0028	0.0031	0.0136
Leishmania major	threonyl-tRNA synthetase, putative	0.0025	0.0016	0.0218
Toxoplasma gondii	calcium-dependent protein kinase CDPK2A	0.0137	0.0612	0.0925
Onchocerca volvulus		0.0063	0.0217	1
Trypanosoma brucei	myo-inositol/proton symporter (MIT)	0.0063	0.0217	0.303
Brugia malayi	latrophilin 2 splice variant baaae	0.0069	0.0251	0.109
Brugia malayi	Major Facilitator Superfamily protein	0.0063	0.0217	0.094
Loa Loa (eye worm)	major facilitator superfamily transporter	0.0063	0.0217	0.094
Plasmodium falciparum	proline--tRNA ligase	0.0156	0.0715	0.0701
Toxoplasma gondii	protein kinase, putative	0.1263	0.6617	1
Toxoplasma gondii	glycyl-tRNA synthetase	0.0025	0.0016	0.0024
Brugia malayi	probable proline-trna synthetase - fission yeast, putative	0.0025	0.0016	0.0051
Loa Loa (eye worm)	calcium/calmodulin-dependent protein kinase ID	0.0137	0.0611	0.2686
Onchocerca volvulus		0.0063	0.0217	1
Mycobacterium tuberculosis	Probable threonyl-tRNA synthetase ThrS (threonine-tRNA synthetase)(ThrRS) (threonine-tRNA ligase)	0.0025	0.0016	0.0468
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0447	0.2266	0.6243
Onchocerca volvulus		0.0048	0.0137	0.6268
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0023	0.0004	0.01
Echinococcus multilocularis	solute carrier family 22	0.0063	0.0217	0.0558
Toxoplasma gondii	calcium-dependent protein kinase CDPK2B	0.0137	0.0612	0.0925
Leishmania major	eukaryotic initiation factor 4a, putative	0.0028	0.0031	0.0431
Loa Loa (eye worm)	bifunctional aminoacyl-tRNA synthetase	0.0055	0.0175	0.0756
Treponema pallidum	prolyl-tRNA synthetase	0.0047	0.0134	1
Trichomonas vaginalis	CAMK family protein kinase	0.0137	0.0611	0.2699
Trichomonas vaginalis	myo-inositol transporter, putative	0.0063	0.0217	0.0956
Trichomonas vaginalis	lysyl-tRNA synthetase, putative	0.01	0.0414	0.1826
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Trypanosoma brucei	glucose transporter, putative	0.0139	0.0621	0.868
Loa Loa (eye worm)	hypothetical protein	0.0137	0.0611	0.2686
Trichomonas vaginalis	sugar transporter, putative	0.0139	0.0621	0.274
Brugia malayi	eukaryotic initiation factor 4A	0.0028	0.0031	0.0118
Plasmodium falciparum	mitogen-activated protein kinase 2	0.0723	0.3734	0.3724
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Onchocerca volvulus		0.0063	0.0217	1
Trypanosoma cruzi	hexose transporter, putative	0.0063	0.0217	0.303
Brugia malayi	Helicase conserved C-terminal domain containing protein	0.0038	0.0086	0.0364
Toxoplasma gondii	prolyl-tRNA synthetase (ProRS)	0.0156	0.0715	0.1081
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0137	0.0611	0.1653
Trypanosoma cruzi	threonyl-tRNA synthetase, putative	0.0025	0.0016	0.0218
Trypanosoma brucei	Eukaryotic initiation factor 4A-1	0.0028	0.0031	0.0431
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	0.0004	0.0058
Mycobacterium ulcerans	lysyl-tRNA synthetase	0.01	0.0414	1
Echinococcus multilocularis	lysyl tRNA synthetase	0.01	0.0414	0.1104
Plasmodium falciparum	ATP-dependent RNA helicase SUV3, putative	0.0038	0.0086	0.0071
Plasmodium vivax	proline--tRNA ligase, putative	0.0156	0.0715	0.0701
Plasmodium vivax	lysine--tRNA ligase, putative	0.01	0.0414	0.0399
Trichomonas vaginalis	conserved hypothetical protein	0.0139	0.0621	0.274
Trypanosoma cruzi	prolyl-tRNA synthetase, putative	0.0156	0.0715	1
Trypanosoma brucei	glycyl-tRNA synthetase, putative	0.0025	0.0016	0.0218
Echinococcus multilocularis	solute carrier family 2, facilitated glucose	0.0447	0.2266	0.6243
Mycobacterium tuberculosis	Probable conserved integral membrane transport protein	0.0063	0.0217	0.6499
Schistosoma mansoni	glucose transporter	0.0063	0.0217	0.0558
Brugia malayi	threonyl-tRNA synthetase, cytoplasmic	0.0025	0.0016	0.0051
Brugia malayi	Major Facilitator Superfamily protein	0.0063	0.0217	0.094
Onchocerca volvulus		0.0063	0.0217	1
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0217	0.094
Trypanosoma cruzi	lysyl-tRNA synthetase, putative	0.01	0.0414	0.5783
Trichomonas vaginalis	prolyl-tRNA synthetase, putative	0.0134	0.0597	0.2634
Entamoeba histolytica	hypothetical protein	0.0038	0.0085	0.1338
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0447	0.2266	0.6243
Toxoplasma gondii	sugar transporter ST2	0.0063	0.0217	0.0327
Echinococcus granulosus	solute carrier family 22	0.0063	0.0217	0.0558
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Echinococcus multilocularis	General substrate transporter	0.0384	0.193	0.5313
Onchocerca volvulus		0.0063	0.0217	1
Plasmodium vivax	CDK-related protein kinase 6, putative	0.1898	1	1
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Toxoplasma gondii	facilitative glucose transporter GT1	0.0447	0.2266	0.3424
Trichomonas vaginalis	sugar transporter, putative	0.0139	0.0621	0.274
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0217	0.094
Echinococcus granulosus	GPCR family 2	0.0032	0.0052	0.0102
Loa Loa (eye worm)	CAMK/CAMK2 protein kinase	0.0137	0.0611	0.2686
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0032	0.0052	0.0213
Entamoeba histolytica	glycyl-tRNA synthetase, putative	0.0025	0.0016	0.0189
Brugia malayi	Cam kinase protein 1	0.0137	0.0611	0.2686
Mycobacterium ulcerans	prolyl-tRNA synthetase	0.0047	0.0134	0.3243
Schistosoma mansoni	protein kinase	0.0137	0.0611	0.1653
Trichomonas vaginalis	sugar transporter, putative	0.0139	0.0621	0.274
Toxoplasma gondii	sugar transporter ST3	0.0063	0.0217	0.0327
Onchocerca volvulus		0.0063	0.0217	1
Trypanosoma cruzi	Eukaryotic initiation factor 4A-1	0.0028	0.0031	0.0431
Echinococcus multilocularis	eukaryotic initiation factor 4A III	0.0028	0.0031	0.0042
Schistosoma mansoni	hypothetical protein	0.0447	0.2266	0.6243
Schistosoma mansoni	sugar transporter	0.0063	0.0217	0.0558
Echinococcus granulosus	Sugar transporter ERD6 protein	0.0063	0.0217	0.0558
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0023	0.0004	0.007
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0016	0.0051
Echinococcus multilocularis	synaptic vesicle 2 protein	0.0063	0.0217	0.0558
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0023	0.0004	0.0124
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Trichomonas vaginalis	sugar transport protein, putative	0.0063	0.0217	0.0956
Echinococcus granulosus	eukaryotic initiation factor 4A III	0.0028	0.0031	0.0042
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0217	0.094
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0023	0.0004	0.01
Brugia malayi	Sugar transporter family protein	0.0063	0.0217	0.094
Plasmodium vivax	mitogen-activated protein kinase 2, putative	0.0723	0.3734	0.3724
Trypanosoma cruzi	hexose transporter, putative	0.0076	0.0286	0.3994
Plasmodium falciparum	calcium-dependent protein kinase 1	0.0137	0.0612	0.0597
Onchocerca volvulus		0.0063	0.0217	1
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0217	0.094
Giardia lamblia	Hexose transporter	0.0063	0.0217	0.346
Schistosoma mansoni	nuclear transcription factor X-box binding 1 (nfx1)	0.0063	0.0217	0.0558
Brugia malayi	hypothetical protein	0.0038	0.0085	0.0359
Echinococcus multilocularis	solute carrier family 22	0.0063	0.0217	0.0558
Loa Loa (eye worm)	sugar transporter	0.0447	0.2266	1
Loa Loa (eye worm)	sugar transporter	0.0063	0.0217	0.094
Leishmania major	protein kinase, putative	0.0137	0.0611	0.855
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0004	0.01
Echinococcus granulosus	General substrate transporter	0.0384	0.193	0.5313
Mycobacterium leprae	Possible lysyl-tRNA synthetase 2 LysX	0.01	0.0414	0.6932
Echinococcus multilocularis	Sugar transporter ERD6 protein	0.0063	0.0217	0.0558
Schistosoma mansoni	protein kinase	0.0137	0.0611	0.1653
Brugia malayi	Bifunctional aminoacyl-tRNA synthetase	0.0134	0.0597	0.262
Plasmodium falciparum	calcium-dependent protein kinase 2	0.0137	0.0612	0.0597
Plasmodium falciparum	calcium-dependent protein kinase 4	0.0137	0.0612	0.0597
Schistosoma mansoni	transcription factor LCR-F1	0.0038	0.0085	0.0194
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0038	0.0085	0.0194
Echinococcus multilocularis	glutamyl tRNA synthetase cytoplasmic	0.0134	0.0597	0.1612
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0137	0.0611	0.1653
Entamoeba histolytica	hypothetical protein	0.01	0.0414	0.6742
Plasmodium vivax	calcium-dependent protein kinase 4, putative	0.0137	0.0612	0.0597
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0217	0.094
Onchocerca volvulus		0.0063	0.0217	1
Echinococcus granulosus	solute carrier family 22	0.0063	0.0217	0.0558
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0038	0.0085	0.0194
Trypanosoma brucei	glucose transporter, putative	0.0139	0.0621	0.868
Trichomonas vaginalis	sugar transporter, putative	0.0063	0.0217	0.0956
Trypanosoma brucei	glucose transporter, putative	0.0139	0.0621	0.868
Loa Loa (eye worm)	hypothetical protein	0.0069	0.0251	0.109
Trypanosoma cruzi	hexose transporter	0.0139	0.0621	0.868
Mycobacterium ulcerans	fusion protein of transposase for IS2606 and sialic acid-transport integral membrane protein NanT	0.0063	0.0217	0.5239
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0217	0.094
Trypanosoma brucei	ATP-dependent RNA and DNA helicase, mitochondrial, putative	0.0038	0.0086	0.1207
Plasmodium falciparum	eukaryotic initiation factor 4A	0.0028	0.0031	0.0015
Brugia malayi	major facilitator superfamily protein	0.0063	0.0217	0.094
Mycobacterium ulcerans	threonyl-tRNA synthetase	0.0025	0.0016	0.0377
Echinococcus multilocularis	calcium dependent protein kinase	0.0128	0.0566	0.1528
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0217	0.094
Trichomonas vaginalis	lysyl-tRNA synthetase, putative	0.0088	0.0348	0.1536
Mycobacterium ulcerans	glycyl-tRNA synthetase	0.0025	0.0016	0.0377
Mycobacterium ulcerans	hypothetical protein	0.0023	0.0004	0.01

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 7.7 uM	Antiproliferative activity against human NCI-H460 cells after 72 hrs by trypan blue test	ChEMBL.	18077173
IC50 (functional)	= 7.7 uM	Antiproliferative activity against human NCI-H460 cells after 72 hrs by trypan blue test	ChEMBL.	18077173
IC50 (functional)	> 20 uM	Antiproliferative activity against human HeLa cells after 72 hrs by trypan blue test	ChEMBL.	18077173
IC50 (functional)	> 20 uM	Antiproliferative activity against human HL60 cells after 72 hrs by trypan blue test	ChEMBL.	18077173
IC50 (functional)	> 20 uM	Antiproliferative activity against human HeLa cells after 72 hrs by trypan blue test	ChEMBL.	18077173
IC50 (functional)	> 20 uM	Antiproliferative activity against human HL60 cells after 72 hrs by trypan blue test	ChEMBL.	18077173

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	ChEMBL23	18077173

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.

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External resources for this compound

No external resources registered for this compound

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 522439