TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 361.974 | Formula: C10H6Br2N2O3
H donors: 2 H acceptors: 2 LogP: 2.64 Rotable bonds: 1
Rule of 5 violations (Lipinski): 1
SMILES: Brc1cc(Br)c2c(c1)c(=O)c(c(o2)N)C(=O)N
InChi: 1S/C10H6Br2N2O3/c11-3-1-4-7(15)6(9(13)16)10(14)17-8(4)5(12)2-3/h1-2H,14H2,(H2,13,16)
InChiKey: JGHBNLWCZJLOKP-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 cruzi	trans-sialidase, Group I, putative	0.0029	0.6512	0.6512
Echinococcus multilocularis	multidrug resistance associated protein 1	0.0022	0.382	0.382
Echinococcus granulosus	multidrug resistance protein 1	0.0015	0.1332	0.1332
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
Trypanosoma brucei	trans-sialidase, putative	0.0029	0.6512	0.4356
Loa Loa (eye worm)	hypothetical protein	0.0025	0.5019	0.4952
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0025	0.5019	0.4253
Trichomonas vaginalis	abcb9, putative	0.0025	0.5019	0.4253
Echinococcus multilocularis	multidrug resistance associated protein 7	0.0022	0.382	0.382
Onchocerca volvulus		0.0025	0.5019	0.5
Trichomonas vaginalis	ubiquitin-conjugating enzyme E2, putative	0.0038	1	1
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
Brugia malayi	ABC transporter family protein	0.0025	0.5019	0.194
Loa Loa (eye worm)	hypothetical protein	0.0025	0.5019	0.4952
Trichomonas vaginalis	ABC transporter, half transporter, putative	0.0025	0.5019	0.4253
Echinococcus granulosus	multidrug resistance associated protein 1	0.0022	0.382	0.382
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0025	0.5019	0.5019
Leishmania major	ATP-binding cassette protein subfamily B, member 2, putative	0.0025	0.5019	0.194
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0025	0.5019	0.4253
Giardia lamblia	Multidrug resistance-associated protein 1	0.0022	0.382	1
Trypanosoma cruzi	trans-sialidase, putative	0.0029	0.6512	0.6512
Leishmania major	p-glycoprotein	0.0025	0.5019	0.194
Trypanosoma cruzi	trans-sialidase, putative	0.0029	0.651	0.651
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	0.4356
Entamoeba histolytica	P-glyco protein 6, putative	0.0025	0.5019	0.194
Loa Loa (eye worm)	ATP-binding cassette sub-family B member 2	0.0025	0.5019	0.4952
Trichomonas vaginalis	ABC transporter, putative	0.0025	0.5019	0.4253
Trichomonas vaginalis	abcb9, putative	0.0025	0.5019	0.4253
Echinococcus granulosus	multidrug resistance protein 1	0.0015	0.1332	0.1332
Schistosoma mansoni	ubiquitin conjugating enzyme 13	0.0038	1	1
Schistosoma mansoni	multidrug resistance protein	0.0025	0.5019	0.194
Plasmodium vivax	ubiquitin-conjugating enzyme E2 N, putative	0.0038	1	1
Trypanosoma brucei	trans-sialidase, putative	0.0029	0.6512	0.4356
Loa Loa (eye worm)	hypothetical protein	0.0025	0.4886	0.4817
Trypanosoma brucei	trans-sialidase, putative	0.0029	0.6512	0.4356
Echinococcus granulosus	5'partial\|ATP binding cassette sub family B	0.0025	0.4886	0.4886
Loa Loa (eye worm)	hypothetical protein	0.0022	0.382	0.3736
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0025	0.5019	0.4253
Trypanosoma cruzi	multidrug resistance protein E, putative	0.0022	0.382	0.382
Entamoeba histolytica	P-glycoprotein-2	0.0025	0.5019	0.194
Entamoeba histolytica	P-glycoprotein-2	0.0025	0.5019	0.194
Loa Loa (eye worm)	hypothetical protein	0.0021	0.3687	0.3602
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.0025	0.5019	0.5019
Giardia lamblia	Multidrug resistance-associated protein 1	0.0022	0.382	1
Entamoeba histolytica	P-glycoprotein 5, putative	0.0025	0.5019	0.194
Entamoeba histolytica	P-glycoprotein-2, putative	0.0025	0.5019	0.194
Toxoplasma gondii	ABC transporter transmembrane region domain-containing protein	0.0025	0.5019	0.194
Trypanosoma brucei	trans-sialidase	0.0029	0.6512	0.4356
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.0025	0.5019	0.5019
Trypanosoma cruzi	trans-sialidase, putative	0.0029	0.6512	0.6512
Trypanosoma cruzi	trans-sialidase, Group I, putative	0.0029	0.6512	0.6512
Loa Loa (eye worm)	multidrug resistance protein 3	0.0025	0.5019	0.4952
Trypanosoma cruzi	ubiquitin-conjugating enzyme E2, putative	0.0038	1	1
Loa Loa (eye worm)	ubiquitin conjugating enzyme protein 13	0.0038	1	1
Trypanosoma cruzi	trans-sialidase, Group I, putative	0.0029	0.6512	0.6512
Echinococcus multilocularis	multidrug resistance protein 1	0.0025	0.5019	0.5019
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.0025	0.5019	0.5019
Trichomonas vaginalis	ATP-binding cassette transporter, putative	0.0025	0.5019	0.4253
Loa Loa (eye worm)	ubiquitin conjugating enzyme protein 13	0.0038	1	1
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
Echinococcus multilocularis	ATP binding cassette sub family B	0.0025	0.4886	0.4886
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0025	0.5019	0.4253
Trypanosoma cruzi	trans-sialidase, putative	0.0029	0.6512	0.6512
Trypanosoma cruzi	trans-sialidase, putative	0.0029	0.651	0.651
Plasmodium falciparum	ubiquitin-conjugating enzyme E2 N, putative	0.0038	1	1
Echinococcus granulosus	multidrug resistance associated protein 7	0.0022	0.382	0.382
Toxoplasma gondii	ubiquitin-conjugating enzyme subfamily protein	0.0038	1	1
Trichomonas vaginalis	ABC transporter, putative	0.0025	0.5019	0.4253
Trichomonas vaginalis	taga, putative	0.0025	0.5019	0.4253
Trypanosoma brucei	ubiquitin-protein ligase, putative	0.0038	1	1
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0025	0.5019	0.4253
Leishmania major	ubiquitin-conjugating enzyme e2, putative	0.0038	1	1
Mycobacterium tuberculosis	Probable transmembrane multidrug efflux pump	0.0025	0.5019	0.5
Entamoeba histolytica	P-glycoprotein-5	0.0025	0.5019	0.194
Chlamydia trachomatis	ABC transporter ATP binding protein/permease	0.0025	0.5019	0.5
Echinococcus granulosus	multidrug resistance protein 1	0.0025	0.5019	0.5019
Schistosoma mansoni	smdr2	0.0025	0.5019	0.194
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
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0025	0.5019	0.4253
Giardia lamblia	ABC transporter, putative	0.0022	0.382	1
Trypanosoma cruzi	multidrug resistance-associated protein, putative	0.0022	0.382	0.382
Entamoeba histolytica	ubiquitin-conjugating enzyme family protein	0.0038	1	1
Trichomonas vaginalis	ABC transporter, putative	0.0025	0.5019	0.4253
Schistosoma mansoni	multidrug resistance protein	0.0025	0.5019	0.194
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0025	0.5019	0.4253
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0025	0.5019	0.4253
Echinococcus multilocularis	multidrug resistance protein 1	0.0015	0.1332	0.1332
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0025	0.5019	0.5019
Trichomonas vaginalis	ABC transporter, putative	0.0025	0.5019	0.4253
Loa Loa (eye worm)	hypothetical protein	0.0022	0.382	0.3736
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
Giardia lamblia	MRP-like ABC transporter	0.0022	0.382	1
Echinococcus multilocularis	ubiquitin conjugating enzyme E2 N	0.0038	1	1
Trypanosoma cruzi	trans-sialidase, Group I, putative	0.0029	0.6512	0.6512
Toxoplasma gondii	ATP-binding cassette transporter ABC.B1	0.0025	0.5019	0.194
Echinococcus multilocularis	multidrug resistance protein 1	0.0025	0.5019	0.5019
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0025	0.5019	0.5019
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0025	0.5019	0.5019
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0025	0.5019	0.4253
Trichomonas vaginalis	abcb9, putative	0.0025	0.5019	0.4253
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0025	0.5019	0.4253
Echinococcus granulosus	ubiquitin conjugating enzyme E2 N	0.0038	1	1
Trypanosoma cruzi	trans-sialidase, Group I, putative	0.0029	0.6512	0.6512
Trypanosoma brucei	trans-sialidase, putative	0.0029	0.6512	0.4356
Loa Loa (eye worm)	ABC transporter transmembrane region family protein	0.0022	0.382	0.3736
Brugia malayi	multidrug resistance protein 3	0.0025	0.5019	0.194
Entamoeba histolytica	P-glycoprotein-1	0.0025	0.5019	0.194
Trypanosoma cruzi	trans-sialidase, putative	0.0029	0.651	0.651
Trichomonas vaginalis	ubiquitin-conjugating enzyme E2, putative	0.0038	1	1
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
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, 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
Trypanosoma cruzi	trans-sialidase, putative	0.0029	0.651	0.651
Trichomonas vaginalis	ATP-binding cassette transporter, putative	0.0025	0.5019	0.4253
Schistosoma mansoni	multidrug resistance protein	0.0025	0.5019	0.194
Trypanosoma cruzi	multidrug resistance-associated protein, putative	0.0022	0.382	0.382
Trichomonas vaginalis	ATP-binding cassette transporter, putative	0.0025	0.5019	0.4253
Brugia malayi	ubiquitin conjugating enzyme protein 13	0.0038	1	1
Trypanosoma cruzi	trans-sialidase, Group I, putative	0.0029	0.6512	0.6512

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: CHEMBL2288714

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 1807093