TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 281.354 | Formula: C11H11N3O2S2
H donors: 0 H acceptors: 0 LogP: 2.28 Rotable bonds: 2
Rule of 5 violations (Lipinski): 1
SMILES: CN(c1ss/c(=N\c2ccc3c(c2)OCO3)/n1)C
InChi: 1S/C11H11N3O2S2/c1-14(2)11-13-10(17-18-11)12-7-3-4-8-9(5-7)16-6-15-8/h3-5H,6H2,1-2H3/b12-10-
InChiKey: FKFJRMXVYQAVCD-BENRWUELSA-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
Onchocerca volvulus		0.0042	0.0029	0.2136
Echinococcus granulosus	bifunctional protein NCOAT	1.0978	1	1
Trypanosoma cruzi	glucose transporter, putative	0.0042	0.0029	0.2645
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0346	0.0306	0.0306
Plasmodium vivax	calcium-dependent protein kinase 1, putative	0.0389	0.0346	1
Loa Loa (eye worm)	calcium/calmodulin-dependent protein kinase ID	0.0389	0.0345	0.0344
Schistosoma mansoni	sugar transporter	0.0042	0.0029	0.0029
Brugia malayi	serine/threonine kinase 12	0.0131	0.0111	0.0109
Toxoplasma gondii	sugar transporter ST2	0.0042	0.0029	0.0846
Trypanosoma brucei	myo-inositol/proton symporter (MIT)	0.0042	0.0029	0.0846
Plasmodium falciparum	hexose transporter	0.0346	0.0306	0.8862
Trichomonas vaginalis	conserved hypothetical protein	0.0075	0.0059	0.0952
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0075	0.0059	0.1717
Trypanosoma cruzi	hexose transporter, putative	0.0042	0.0029	0.2645
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0389	0.0345	0.0345
Plasmodium falciparum	major facilitator superfamily domain-containing protein, putative	0.0042	0.0029	0.0846
Entamoeba histolytica	serine/threonine- protein kinase 6 , putative	0.0131	0.0111	0.32
Trypanosoma brucei	glucose transporter 2A	0.0075	0.0059	0.1717
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0029	0.0028
Schistosoma mansoni	glucose transport protein	0.0346	0.0306	0.0306
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0029	0.0028
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0029	0.0028
Schistosoma mansoni	protein kinase	0.0389	0.0345	0.0345
Plasmodium vivax	calcium-dependent protein kinase 4, putative	0.0389	0.0346	1
Toxoplasma gondii	transporter, major facilitator family protein	0.0042	0.0029	0.0846
Echinococcus multilocularis	aurora kinase A	0.0131	0.0111	0.0111
Brugia malayi	hypothetical protein	0.0042	0.0029	0.0028
Onchocerca volvulus	Tyrosine kinase homolog	0.0154	0.0131	1
Loa Loa (eye worm)	AUR protein kinase	0.0131	0.0111	0.0109
Plasmodium falciparum	calcium-dependent protein kinase 4	0.0389	0.0346	1
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0029	0.0028
Onchocerca volvulus		0.0042	0.0029	0.2136
Toxoplasma gondii	sugar transporter ST1	0.0042	0.0029	0.0846
Mycobacterium tuberculosis	Probable dicarboxylic acid transport integral membrane protein KgtP (dicarboxylate transporter)	0.0042	0.0029	0.5
Brugia malayi	major facilitator superfamily protein	0.0042	0.0029	0.0028
Leishmania major	hypothetical protein, conserved	0.0042	0.0029	0.0846
Echinococcus granulosus	solute carrier family 22	0.0042	0.0029	0.0029
Giardia lamblia	Aurora kinase	0.0131	0.0111	1
Onchocerca volvulus		0.0042	0.0029	0.2136
Echinococcus multilocularis	roundabout 2	0.0016	0.0005	0.0005
Plasmodium falciparum	calcium-dependent protein kinase 5	0.0389	0.0346	1
Schistosoma mansoni	Hyaluronidase	1.0978	1	1
Brugia malayi	Major Facilitator Superfamily protein	0.0042	0.0029	0.0028
Schistosoma mansoni	serine/threonine protein kinase	0.0012	0.0002	0.0002
Onchocerca volvulus	Putative transporter	0.0042	0.0029	0.2136
Echinococcus granulosus	synaptic vesicle 2 protein	0.0042	0.0029	0.0029
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0389	0.0345	0.0345
Echinococcus multilocularis	serine:threonine protein kinase 12 B	0.0131	0.0111	0.0111
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0029	0.0028
Trypanosoma brucei	calcium/calmodulin-dependent protein kinase, putative	0.0389	0.0345	1
Loa Loa (eye worm)	CAMK/MLCK protein kinase	0.0015	0.0005	0.0003
Schistosoma mansoni	protein kinase	0.0131	0.0111	0.0111
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0389	0.0345	0.0345
Loa Loa (eye worm)	CAMK/CAMK2 protein kinase	0.0389	0.0345	0.0344
Onchocerca volvulus		0.0042	0.0029	0.2136
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0029	0.0028
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0029	0.0028
Schistosoma mansoni	sugar transporter	0.0042	0.0029	0.0029
Plasmodium vivax	hexose transporter	0.0346	0.0306	0.8757
Onchocerca volvulus		0.0042	0.0029	0.2136
Loa Loa (eye worm)	CMGC/CDK/CDK8 protein kinase	0.0152	0.0129	0.0127
Echinococcus granulosus	solute carrier family 22	0.0042	0.0029	0.0029
Wolbachia endosymbiont of Brugia malayi	major facilitator superfamily permease	0.0042	0.0029	0.5
Mycobacterium ulcerans	sugar-transport integral membrane protein SugI	0.0042	0.0029	0.5
Echinococcus multilocularis	cyclin dependent kinase 19	0.0152	0.0129	0.0129
Schistosoma mansoni	aminopeptidase P homologue (M24 family)	1.0978	1	1
Echinococcus granulosus	twitchin	0.0022	0.0011	0.0011
Leishmania major	glucose transporter, lmgt2	0.0075	0.0059	0.1717
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0005	0.0004
Toxoplasma gondii	calcium-dependent protein kinase CDPK3	0.0389	0.0346	1
Entamoeba histolytica	serine/threonine- protein kinase 6, putative	0.0131	0.0111	0.32
Plasmodium falciparum	serine/threonine protein kinase, putative	0.0131	0.0111	0.3198
Entamoeba histolytica	serine/threonine protein kinase 6, putative	0.0131	0.0111	0.32
Toxoplasma gondii	sugar transporter ST3	0.0042	0.0029	0.0846
Loa Loa (eye worm)	TK/KIN16 protein kinase	0.0165	0.0141	0.014
Echinococcus multilocularis	General substrate transporter	0.0304	0.0268	0.0268
Plasmodium falciparum	calcium-dependent protein kinase 1	0.0389	0.0346	1
Echinococcus granulosus	serine:threonine protein kinase 12 B	0.0131	0.0111	0.0111
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0029	0.0028
Plasmodium falciparum	calcium-dependent protein kinase 3	0.0389	0.0346	1
Trypanosoma brucei	glucose transporter, putative	0.0075	0.0059	0.1717
Toxoplasma gondii	aurora kinase	0.0131	0.0111	0.3198
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0389	0.0345	0.0345
Entamoeba histolytica	protein kinase domain containing protein	0.0131	0.0111	0.32
Brugia malayi	Sugar transporter family protein	0.0346	0.0306	0.0305
Trichomonas vaginalis	sugar transporter, putative	0.0075	0.0059	0.0952
Schistosoma mansoni	serine/threonine protein kinase	0.0131	0.0111	0.0111
Brugia malayi	hypothetical protein	0.0042	0.0029	0.0028
Echinococcus multilocularis	titin	0.0012	0.0002	0.0002
Schistosoma mansoni	sugar transporter	0.0042	0.0029	0.0029
Brugia malayi	Protein kinase domain containing protein	0.0152	0.0129	0.0127
Trichomonas vaginalis	AGC family protein kinase	0.0131	0.0111	0.2571
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0029	0.0028
Mycobacterium ulcerans	integral membrane transport protein	0.0042	0.0029	0.5
Plasmodium falciparum	calcium-dependent protein kinase 2	0.0389	0.0346	1
Trypanosoma cruzi	hexose transporter, putative	0.0075	0.0059	0.5368
Schistosoma mansoni	hypothetical protein	0.0346	0.0306	0.0306
Echinococcus granulosus	calcium dependent protein kinase	0.038	0.0337	0.0337
Trypanosoma cruzi	hexose transporter, putative	0.0033	0.0021	0.188
Onchocerca volvulus		0.0042	0.0029	0.2136
Trichomonas vaginalis	sugar transporter, putative	0.0075	0.0059	0.0952
Plasmodium vivax	serine/threonine protein kinase 6, putative	0.0131	0.0111	0.2569
Entamoeba histolytica	protein kinase, putative	0.0131	0.0111	0.32
Loa Loa (eye worm)	hypothetical protein	0.0013	0.0003	0.0001
Onchocerca volvulus		0.0042	0.0029	0.2136
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0389	0.0345	0.0345
Loa Loa (eye worm)	sugar transporter	0.0346	0.0306	0.0305
Brugia malayi	Major Facilitator Superfamily protein	0.0042	0.0029	0.0028
Leishmania major	protein kinase, putative	0.0389	0.0345	1
Echinococcus multilocularis	solute carrier family 22	0.0042	0.0029	0.0029
Echinococcus multilocularis	synaptic vesicle 2 protein	0.0042	0.0029	0.0029
Trypanosoma cruzi	hexose transporter, putative	0.0075	0.0059	0.5368
Onchocerca volvulus		0.0042	0.0029	0.2136
Plasmodium vivax	calcium-dependent protein kinase 3, putative	0.0389	0.0346	1
Loa Loa (eye worm)	AUR protein kinase	0.0131	0.0111	0.0109
Onchocerca volvulus		0.0042	0.0029	0.2136
Onchocerca volvulus		0.0042	0.0029	0.2136
Entamoeba histolytica	protein kinase, putative	0.0131	0.0111	0.32
Echinococcus granulosus	titin	0.0012	0.0002	0.0002
Onchocerca volvulus		0.0151	0.0128	0.9753
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type 1	0.0389	0.0345	0.0345
Onchocerca volvulus		0.0042	0.0029	0.2136
Echinococcus multilocularis	solute carrier family 22	0.0042	0.0029	0.0029
Loa Loa (eye worm)	AUR protein kinase	0.0131	0.0111	0.0109
Loa Loa (eye worm)	gastrulation defective protein 1	0.0142	0.012	0.0119
Trichomonas vaginalis	glucose transporter, putative	0.0075	0.0059	0.0952
Trypanosoma brucei	glucose transporter, putative	0.0075	0.0059	0.1717
Trypanosoma brucei	aurora B kinase	0.0131	0.0111	0.32
Trypanosoma brucei	glucose transporter, putative	0.0075	0.0059	0.1717
Loa Loa (eye worm)	hypothetical protein	0.0389	0.0345	0.0344
Echinococcus granulosus	solute carrier family 22	0.0042	0.0029	0.0029
Trypanosoma brucei	glucose transporter, putative	0.0075	0.0059	0.1717
Trichomonas vaginalis	sugar transporter, putative	0.0075	0.0059	0.0952
Echinococcus granulosus	titin	0.0012	0.0002	0.0002
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0029	0.0028
Echinococcus granulosus	Sugar transporter ERD6 protein	0.0042	0.0029	0.0029
Plasmodium vivax	calcium-dependent protein kinase, putative	0.0389	0.0346	1
Brugia malayi	Calcium/calmodulin-dependent protein kinase type II alpha chain	0.0389	0.0345	0.0344
Brugia malayi	major facilitator superfamily protein	0.0042	0.0029	0.0028
Echinococcus granulosus	neurotracting:lsamp:neurotrimin:obcam	0.0013	0.0003	0.0003
Echinococcus granulosus	cyclin dependent kinase 19	0.0152	0.0129	0.0129
Leishmania major	myo-inositol/proton symporter (MIT)	0.0042	0.0029	0.0846
Trypanosoma cruzi	hexose transporter, putative	0.0075	0.0059	0.5368
Schistosoma mansoni	sugar transporter	0.0042	0.0029	0.0029
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0346	0.0306	0.0306
Mycobacterium ulcerans	fusion protein of transposase for IS2606 and sialic acid-transport integral membrane protein NanT	0.0042	0.0029	0.5
Echinococcus granulosus	General substrate transporter	0.0304	0.0268	0.0268
Brugia malayi	Sugar transporter family protein	0.0042	0.0029	0.0028
Leishmania major	glucose transporter, lmgt3	0.0075	0.0059	0.1717
Onchocerca volvulus		0.0042	0.0029	0.2136
Brugia malayi	serine/threonine-protein kinase 6	0.0131	0.0111	0.0109
Echinococcus multilocularis	twitchin	0.0012	0.0002	0.0002
Trichomonas vaginalis	CAMK family protein kinase	0.0389	0.0345	1
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0389	0.0345	0.0345
Entamoeba histolytica	protein kinase, putative	0.0389	0.0345	1
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0389	0.0345	0.0345
Brugia malayi	Sugar transporter family protein	0.0042	0.0029	0.0028
Schistosoma mansoni	glucose transporter	0.0042	0.0029	0.0029
Trichomonas vaginalis	conserved hypothetical protein	0.0075	0.0059	0.0952
Toxoplasma gondii	facilitative glucose transporter GT1	0.0346	0.0306	0.8862
Schistosoma mansoni	serine/threonine protein kinase	0.0152	0.0129	0.0129
Onchocerca volvulus		0.0042	0.0029	0.2136
Trichomonas vaginalis	conserved hypothetical protein	0.0346	0.0306	0.8763
Loa Loa (eye worm)	major facilitator superfamily transporter	0.0042	0.0029	0.0028
Trypanosoma brucei	sugar transporter, putative	0.0042	0.0029	0.0846
Loa Loa (eye worm)	major facilitator superfamily transporter	0.0042	0.0029	0.0028
Schistosoma mansoni	protein kinase	0.0389	0.0345	0.0345
Trypanosoma brucei	glucose transporter 1E	0.0075	0.0059	0.1717
Toxoplasma gondii	calcium-dependent protein kinase CDPK2A	0.0389	0.0346	1
Leishmania major	protein kinase, putative	0.0131	0.0111	0.32
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0346	0.0306	0.0306
Schistosoma mansoni	cell adhesion molecule	0.0013	0.0003	0.0003
Trichomonas vaginalis	AGC family protein kinase	0.0131	0.0111	0.2571
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0029	0.0028
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0029	0.0028
Brugia malayi	Major Facilitator Superfamily protein	0.0042	0.0029	0.0028
Entamoeba histolytica	protein kinase, putative	0.0389	0.0345	1
Trichomonas vaginalis	glucose transporter, putative	0.0075	0.0059	0.0952
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0075	0.0059	0.1717
Echinococcus multilocularis	calcium dependent protein kinase	0.038	0.0337	0.0337
Toxoplasma gondii	calcium-dependent protein kinase CDPK2B	0.0389	0.0346	1
Brugia malayi	Cam kinase protein 1	0.0389	0.0345	0.0344
Trypanosoma cruzi	sugar transporter, putative	0.0042	0.0029	0.2645
Echinococcus granulosus	neuroglian	0.0013	0.0002	0.0002
Schistosoma mansoni	protein kinase	0.0389	0.0345	0.0345
Entamoeba histolytica	protein kinase , putative	0.0131	0.0111	0.32
Trichomonas vaginalis	AGC family protein kinase	0.0131	0.0111	0.2571
Schistosoma mansoni	glucose transport protein	0.0346	0.0306	0.0306
Brugia malayi	hypothetical protein	0.0042	0.0029	0.0028
Echinococcus multilocularis	solute carrier family 2, facilitated glucose	0.0346	0.0306	0.0306
Echinococcus multilocularis	neuroglian	0.0013	0.0002	0.0002
Mycobacterium ulcerans	sugar transporter	0.0042	0.0029	0.5
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0029	0.0028
Echinococcus granulosus	roundabout 2	0.0016	0.0005	0.0005
Trypanosoma cruzi	hexose transporter	0.0075	0.0059	0.5368
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0346	0.0306	0.0306
Trypanosoma brucei	glucose transporter, putative	0.0075	0.0059	0.1717
Echinococcus multilocularis	solute carrier family 22	0.0042	0.0029	0.0029
Trypanosoma brucei	glucose transporter, putative	0.0075	0.0059	0.1717
Schistosoma mansoni	titin	0.0012	0.0002	0.0002
Onchocerca volvulus		0.0042	0.0029	0.2136
Trypanosoma brucei	glucose transporter, putative	0.0075	0.0059	0.1717
Schistosoma mansoni	nephrin	0.0013	0.0002	0.0002
Schistosoma mansoni	serine/threonine protein kinase	0.0012	0.0002	0.0002
Trypanosoma brucei	glucose transporter, putative	0.0075	0.0059	0.1717
Loa Loa (eye worm)	sugar transporter	0.0042	0.0029	0.0028
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0346	0.0306	0.0306
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0029	0.0028
Echinococcus multilocularis	solute carrier family 22	0.0042	0.0029	0.0029
Onchocerca volvulus		0.0042	0.0029	0.2136
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0075	0.0059	0.1717
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0165	0.0141	0.014
Leishmania major	glucose transporter/membrane transporter D2, putative	0.0075	0.0059	0.1717
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0005	0.0004
Mycobacterium tuberculosis	Probable conserved integral membrane transport protein	0.0042	0.0029	0.5
Schistosoma mansoni	nuclear transcription factor X-box binding 1 (nfx1)	0.0042	0.0029	0.0029
Schistosoma mansoni	serine/threonine protein kinase	0.0389	0.0345	0.0345
Onchocerca volvulus		0.0042	0.0029	0.2136
Trichomonas vaginalis	AGC family protein kinase	0.0131	0.0111	0.2571
Echinococcus multilocularis	Sugar transporter ERD6 protein	0.0042	0.0029	0.0029
Loa Loa (eye worm)	hyaluronidase	1.0978	1	1
Schistosoma mansoni	glucose transport protein	0.0346	0.0306	0.0306
Brugia malayi	serine/threonine protein kinase 6	0.0131	0.0111	0.0109
Echinococcus granulosus	aurora kinase A	0.0131	0.0111	0.0111
Echinococcus granulosus	solute carrier family 22	0.0042	0.0029	0.0029
Trypanosoma cruzi	aurora B kinase, putative	0.0131	0.0111	1
Echinococcus multilocularis	bifunctional protein NCOAT	1.0978	1	1
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0346	0.0306	0.0306
Leishmania major	glucose transporter, lmgt1	0.0075	0.0059	0.1717
Loa Loa (eye worm)	hypothetical protein	0.4664	0.4243	0.4242
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0346	0.0306	0.0306
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0029	0.0028

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

ChEMBL: CHEMBL2007742

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1631560