TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 214.177 | Formula: C11H6N2O3
H donors: 1 H acceptors: 2 LogP: 0.75 Rotable bonds: 0
Rule of 5 violations (Lipinski): 1
SMILES: O=c1[nH]cnc2c1c(=O)c1c(o2)cccc1
InChi: 1S/C11H6N2O3/c14-9-6-3-1-2-4-7(6)16-11-8(9)10(15)12-5-13-11/h1-5H,(H,12,13,15)
InChiKey: CTVQDZKOASUJIX-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
Entamoeba histolytica	P-glycoprotein-2	0.0025	0.5019	0.1941
Trypanosoma cruzi	trans-sialidase, putative	0.0029	0.6511	0.6511
Trypanosoma cruzi	trans-sialidase, Group I, putative	0.0029	0.6512	0.6512
Loa Loa (eye worm)	hypothetical protein	0.0022	0.3819	0.3735
Trichomonas vaginalis	ABC transporter, half transporter, putative	0.0025	0.5019	0.4253
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0025	0.5019	0.4253
Schistosoma mansoni	multidrug resistance protein	0.0025	0.5019	0.1941
Echinococcus multilocularis	multidrug resistance associated protein 7	0.0022	0.3819	0.3819
Entamoeba histolytica	P-glyco protein 6, putative	0.0025	0.5019	0.1941
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0025	0.5019	0.4253
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.0025	0.5019	0.5019
Loa Loa (eye worm)	hypothetical protein	0.0021	0.3686	0.36
Schistosoma mansoni	ubiquitin conjugating enzyme 13	0.0038	1	1
Echinococcus multilocularis	multidrug resistance protein 1	0.0015	0.1333	0.1333
Echinococcus multilocularis	ubiquitin conjugating enzyme E2 N	0.0038	1	1
Echinococcus multilocularis	multidrug resistance associated protein 1	0.0022	0.3819	0.3819
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0025	0.5019	0.4253
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0025	0.5019	0.4253
Echinococcus multilocularis	ATP binding cassette sub family B	0.0025	0.4885	0.4885
Loa Loa (eye worm)	ubiquitin conjugating enzyme protein 13	0.0038	1	1
Entamoeba histolytica	P-glycoprotein-2	0.0025	0.5019	0.1941
Trypanosoma cruzi	trans-sialidase, Group I, putative	0.0029	0.6512	0.6512
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0025	0.5019	0.5019
Trypanosoma cruzi	trans-sialidase, putative	0.0029	0.6511	0.6511
Leishmania major	ubiquitin-conjugating enzyme e2, putative	0.0038	1	1
Toxoplasma gondii	ABC transporter transmembrane region domain-containing protein	0.0025	0.5019	0.1941
Giardia lamblia	ABC transporter, putative	0.0022	0.3819	1
Echinococcus granulosus	multidrug resistance protein 1	0.0015	0.1333	0.1333
Trichomonas vaginalis	abcb9, putative	0.0025	0.5019	0.4253
Giardia lamblia	MRP-like ABC transporter	0.0022	0.3819	1
Trichomonas vaginalis	ABC transporter, putative	0.0025	0.5019	0.4253
Entamoeba histolytica	P-glycoprotein-2, putative	0.0025	0.5019	0.1941
Trypanosoma cruzi	trans-sialidase, Group I, putative	0.0029	0.6512	0.6512
Trypanosoma cruzi	trans-sialidase, Group I, putative	0.0029	0.6512	0.6512
Trichomonas vaginalis	ATP-binding cassette transporter, putative	0.0025	0.5019	0.4253
Trypanosoma cruzi	multidrug resistance protein E, putative	0.0022	0.3819	0.3819
Trichomonas vaginalis	abcb9, putative	0.0025	0.5019	0.4253
Trichomonas vaginalis	ATP-binding cassette transporter, putative	0.0025	0.5019	0.4253
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0025	0.5019	0.4253
Loa Loa (eye worm)	hypothetical protein	0.0025	0.4885	0.4816
Entamoeba histolytica	ubiquitin-conjugating enzyme family protein	0.0038	1	1
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.0025	0.5019	0.5019
Trypanosoma cruzi	trans-sialidase, putative	0.0029	0.6511	0.6511
Trypanosoma cruzi	trans-sialidase, putative	0.0029	0.6512	0.6512
Schistosoma mansoni	smdr2	0.0025	0.5019	0.1941
Trichomonas vaginalis	ABC transporter, half transporter, putative	0.0025	0.5019	0.4253
Echinococcus granulosus	multidrug resistance protein 1	0.0025	0.5019	0.5019
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0025	0.5019	0.4253
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0025	0.5019	0.4253
Giardia lamblia	Multidrug resistance-associated protein 1	0.0022	0.3819	1
Toxoplasma gondii	ubiquitin-conjugating enzyme subfamily protein	0.0038	1	1
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0025	0.5019	0.4253
Trichomonas vaginalis	ubiquitin-conjugating enzyme E2, putative	0.0038	1	1
Brugia malayi	ABC transporter family protein	0.0025	0.5019	0.1941
Plasmodium falciparum	ubiquitin-conjugating enzyme E2 N, putative	0.0038	1	1
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0025	0.5019	0.4253
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.0025	0.5019	0.5019
Trypanosoma cruzi	trans-sialidase, Group I, putative	0.0029	0.6512	0.6512
Trypanosoma cruzi	multidrug resistance-associated protein, putative	0.0022	0.3819	0.3819
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0025	0.5019	0.5019
Giardia lamblia	Multidrug resistance-associated protein 1	0.0022	0.3819	1
Echinococcus granulosus	multidrug resistance associated protein 1	0.0022	0.3819	0.3819
Loa Loa (eye worm)	ATP-binding cassette sub-family B member 2	0.0025	0.5019	0.4951
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0025	0.5019	0.4253
Trypanosoma brucei	trans-sialidase, putative	0.0029	0.6512	0.4357
Echinococcus granulosus	multidrug resistance protein 1	0.0015	0.1333	0.1333
Echinococcus granulosus	5'partial\|ATP binding cassette sub family B	0.0025	0.4885	0.4885
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0025	0.5019	0.5019
Brugia malayi	multidrug resistance protein 3	0.0025	0.5019	0.1941
Echinococcus granulosus	multidrug resistance protein 1	0.0025	0.5019	0.5019
Trypanosoma cruzi	trans-sialidase, Group I, putative	0.0029	0.6512	0.6512
Trypanosoma brucei	trans-sialidase, putative	0.0029	0.6512	0.4357
Trichomonas vaginalis	ATP-binding cassette transporter, putative	0.0025	0.5019	0.4253
Entamoeba histolytica	P-glycoprotein-1	0.0025	0.5019	0.1941
Trichomonas vaginalis	ABC transporter, putative	0.0025	0.5019	0.4253
Toxoplasma gondii	ATP-binding cassette transporter ABC.B1	0.0025	0.5019	0.1941
Trypanosoma cruzi	trans-sialidase, putative	0.0029	0.6512	0.6512
Echinococcus granulosus	multidrug resistance associated protein 7	0.0022	0.3819	0.3819
Trichomonas vaginalis	ATP-binding cassette transporter, putative	0.0025	0.5019	0.4253
Trypanosoma cruzi	ubiquitin-conjugating enzyme E2, putative	0.0038	1	1
Echinococcus granulosus	ubiquitin conjugating enzyme E2 N	0.0038	1	1
Trypanosoma cruzi	trans-sialidase, Group I, putative	0.0029	0.6512	0.6512
Echinococcus granulosus	multidrug resistance protein 1	0.0025	0.5019	0.5019
Trypanosoma cruzi	trans-sialidase, Group I, putative	0.0029	0.6512	0.6512
Leishmania major	p-glycoprotein	0.0025	0.5019	0.1941
Trypanosoma cruzi	trans-sialidase, Group I, putative	0.0029	0.6512	0.6512
Trypanosoma cruzi	ubiquitin-conjugating enzyme E2, putative	0.0038	1	1
Trypanosoma cruzi	trans-sialidase, Group I, putative	0.0029	0.6512	0.6512
Trichomonas vaginalis	taga, putative	0.0025	0.5019	0.4253
Trypanosoma cruzi	trans-sialidase, putative	0.0029	0.6512	0.6512
Trypanosoma brucei	trans-sialidase	0.0029	0.6512	0.4357
Onchocerca volvulus		0.0025	0.5019	0.5
Trypanosoma cruzi	trans-sialidase, putative	0.0029	0.6511	0.6511
Entamoeba histolytica	P-glycoprotein-5	0.0025	0.5019	0.1941
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0025	0.5019	0.4253
Trichomonas vaginalis	ABC transporter, putative	0.0025	0.5019	0.4253
Schistosoma mansoni	multidrug resistance protein	0.0025	0.5019	0.1941
Loa Loa (eye worm)	multidrug resistance protein 3	0.0025	0.5019	0.4951
Trypanosoma brucei	trans-sialidase, putative	0.0029	0.6512	0.4357
Loa Loa (eye worm)	hypothetical protein	0.0022	0.3819	0.3735
Trichomonas vaginalis	abcb9, putative	0.0025	0.5019	0.4253
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.0025	0.5019	0.5019
Trypanosoma brucei	ubiquitin-protein ligase, putative	0.0038	1	1
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0025	0.5019	0.5019
Echinococcus multilocularis	multidrug resistance protein 1	0.0025	0.5019	0.5019
Loa Loa (eye worm)	hypothetical protein	0.0025	0.5019	0.4951
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0025	0.5019	0.5019
Loa Loa (eye worm)	ABC transporter transmembrane region family protein	0.0022	0.3819	0.3735
Echinococcus multilocularis	multidrug resistance protein 1	0.0025	0.5019	0.5019
Brugia malayi	ubiquitin conjugating enzyme protein 13	0.0038	1	1
Loa Loa (eye worm)	ubiquitin conjugating enzyme protein 13	0.0038	1	1
Trichomonas vaginalis	ABC transporter, putative	0.0025	0.5019	0.4253
Loa Loa (eye worm)	hypothetical protein	0.0025	0.5019	0.4951
Trypanosoma cruzi	trans-sialidase, Group I, putative	0.0029	0.6512	0.6512
Trypanosoma brucei	trans-sialidase, putative	0.0029	0.6512	0.4357
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0025	0.5019	0.4253
Trichomonas vaginalis	ATP-binding cassette transporter, putative	0.0025	0.5019	0.4253
Leishmania major	ATP-binding cassette protein subfamily B, member 2, putative	0.0025	0.5019	0.1941
Entamoeba histolytica	P-glycoprotein 5, putative	0.0025	0.5019	0.1941
Chlamydia trachomatis	ABC transporter ATP binding protein/permease	0.0025	0.5019	0.5
Trypanosoma cruzi	multidrug resistance-associated protein, putative	0.0022	0.3819	0.3819
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0025	0.5019	0.4253
Trypanosoma brucei	trans-sialidase, putative	0.0029	0.6512	0.4357
Plasmodium vivax	ubiquitin-conjugating enzyme E2 N, putative	0.0038	1	1
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0025	0.5019	0.4253
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0025	0.5019	0.4253
Trichomonas vaginalis	ubiquitin-conjugating enzyme E2, putative	0.0038	1	1
Mycobacterium tuberculosis	Probable transmembrane multidrug efflux pump	0.0025	0.5019	0.5
Schistosoma mansoni	multidrug resistance protein	0.0025	0.5019	0.1941

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: CHEMBL2288715

Bibliographic References

No literature references available for this target.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 1807094