TDR Targets

Basic information

Technical information

TDR Targets ID: 900253
Name: N'-(4-bromo-3-methylphenyl)-N-[(4-chloropheny l)methyl]oxamide
MW: 381.652 | Formula: C16H14BrClN2O2
H donors: 2 H acceptors: 2 LogP: 3.99 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: Clc1ccc(cc1)CNC(=O)C(=O)Nc1ccc(c(c1)C)Br
InChi: 1S/C16H14BrClN2O2/c1-10-8-13(6-7-14(10)17)20-16(22)15(21)19-9-11-2-4-12(18)5-3-11/h2-8H,9H2,1H3,(H,19,21)(H,20,22)
InChiKey: OXTSBYPOSZGLDE-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

N'-(4-bromo-3-methyl-phenyl)-N-[(4-chlorophenyl)methyl]oxamide
N'-(4-bromo-3-methyl-phenyl)-N-(4-chlorobenzyl)oxamide
N'-(4-bromo-3-methyl-phenyl)-N-[(4-chlorophenyl)methyl]ethanediamide
ZINC04868206

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
Schistosoma mansoni	carbonic anhydrase	0.0129	0.185	0.185
Schistosoma mansoni	carbonic anhydrase-related	0.0129	0.185	0.185
Trichomonas vaginalis	valacyclovir hydrolase, putative	0.0225	0.9069	0.5
Toxoplasma gondii	hypothetical protein	0.0129	0.185	0.5
Brugia malayi	Eukaryotic-type carbonic anhydrase family protein	0.0129	0.185	0.185
Schistosoma mansoni	carbonic anhydrase-related	0.0129	0.185	0.185
Echinococcus multilocularis	carbonic anhydrase	0.0129	0.185	0.185
Trichomonas vaginalis	Clan SC, family S33, methylesterase-like serine peptidase	0.0225	0.9069	0.5
Leishmania major	carbonic anhydrase-like protein	0.0238	1	1
Loa Loa (eye worm)	hypothetical protein	0.0129	0.185	0.185
Brugia malayi	Carbonic anhydrase like protein 2 precursor	0.0129	0.185	0.185
Trichomonas vaginalis	Clan SC, family S33, methylesterase-like serine peptidase	0.0225	0.9069	0.5
Echinococcus multilocularis	carbonic anhydrase	0.0129	0.185	0.185
Schistosoma mansoni	carbonic anhydrase-related	0.0129	0.185	0.185
Echinococcus granulosus	carbonic anhydrase	0.0129	0.185	0.185
Brugia malayi	Eukaryotic-type carbonic anhydrase family protein	0.0129	0.185	0.185
Trypanosoma cruzi	carbonic anhydrase-like protein, putative	0.0238	1	1
Entamoeba histolytica	hydrolase, alpha/beta fold family domain containing protein	0.0225	0.9069	0.5
Schistosoma mansoni	carbonic anhydrase II (carbonate dehydratase II)	0.0238	1	1
Trichomonas vaginalis	conserved hypothetical protein	0.0225	0.9069	0.5
Loa Loa (eye worm)	hypothetical protein	0.0129	0.185	0.185
Echinococcus granulosus	carbonic anhydrase	0.0129	0.185	0.185
Plasmodium falciparum	esterase, putative	0.0225	0.9069	1
Loa Loa (eye worm)	eukaryotic-type carbonic anhydrase	0.0238	1	1
Trichomonas vaginalis	conserved hypothetical protein	0.0225	0.9069	0.5
Mycobacterium ulcerans	lysophospholipase	0.0225	0.9069	0.5
Loa Loa (eye worm)	eukaryotic-type carbonic anhydrase	0.0129	0.185	0.185
Trichomonas vaginalis	Clan SC, family S33, methylesterase-like serine peptidase	0.0225	0.9069	0.5
Plasmodium falciparum	lysophospholipase, putative	0.0225	0.9069	1
Trypanosoma brucei	carbonic anhydrase-like protein	0.0238	1	1
Plasmodium falciparum	lysophospholipase, putative	0.0225	0.9069	1
Echinococcus multilocularis	carbonic anhydrase II	0.0238	1	1
Brugia malayi	Carbonic anhydrase like protein 2 precursor	0.0129	0.185	0.185
Echinococcus granulosus	carbonic anhydrase	0.0129	0.185	0.185
Echinococcus granulosus	carbonic anhydrase II	0.0238	1	1
Trichomonas vaginalis	Clan SC, family S33, methylesterase-like serine peptidase	0.0225	0.9069	0.5
Echinococcus multilocularis	carbonic anhydrase	0.0129	0.185	0.185
Mycobacterium leprae	POSSIBLE LYSOPHOSPHOLIPASE	0.0225	0.9069	0.5
Mycobacterium ulcerans	hypothetical protein	0.0225	0.9069	0.5
Mycobacterium tuberculosis	Possible lysophospholipase	0.0225	0.9069	0.5
Schistosoma mansoni	hypothetical protein	0.0129	0.185	0.185
Brugia malayi	Eukaryotic-type carbonic anhydrase family protein	0.0129	0.185	0.185
Entamoeba histolytica	hydrolase, alpha/beta fold family domain containing protein	0.0225	0.9069	0.5
Loa Loa (eye worm)	carbonic anhydrase 3	0.0238	1	1
Plasmodium falciparum	lysophospholipase, putative	0.0225	0.9069	1
Schistosoma mansoni	carbonic anhydrase II (carbonate dehydratase II)	0.0238	1	1
Plasmodium vivax	PST-A protein	0.0225	0.9069	0.5
Trichomonas vaginalis	Clan SC, family S33, methylesterase-like serine peptidase	0.0225	0.9069	0.5
Loa Loa (eye worm)	hypothetical protein	0.0129	0.185	0.185
Trypanosoma cruzi	carbonic anhydrase-like protein, putative	0.0238	1	1
Brugia malayi	Putative carbonic anhydrase 5 precursor	0.0238	1	1

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

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Bibliographic References

No literature references available for this target.

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Detailed information for compound 900253