TDR Targets

Basic information

Technical information

TDR Targets ID: 906190
Name: N'-(3-methylphenyl)-N-[[1-(4-methylphenyl)sul fonylpyrrolidin-2-yl]methyl]oxamide
MW: 415.506 | Formula: C21H25N3O4S
H donors: 2 H acceptors: 4 LogP: 2.94 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: Cc1ccc(cc1)S(=O)(=O)N1CCCC1CNC(=O)C(=O)Nc1cccc(c1)C
InChi: 1S/C21H25N3O4S/c1-15-8-10-19(11-9-15)29(27,28)24-12-4-7-18(24)14-22-20(25)21(26)23-17-6-3-5-16(2)13-17/h3,5-6,8-11,13,18H,4,7,12,14H2,1-2H3,(H,22,25)(H,23,26)
InChiKey: QZAKDKUGFSQDQA-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'-(3-methylphenyl)-N-[[1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]methyl]oxamide
N'-(3-methylphenyl)-N-[[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]methyl]ethanediamide

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
Toxoplasma gondii	isocitrate dehydrogenase	0.0048	0.0432	1
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.062	0.8278	0.8278
Loa Loa (eye worm)	hypothetical protein	0.0424	0.5589	0.5582
Trypanosoma cruzi	isocitrate dehydrogenase, putative	0.0048	0.0432	1
Brugia malayi	Isocitrate dehydrogenase	0.0048	0.0432	0.0432
Brugia malayi	MH1 domain containing protein	0.0051	0.0476	0.0476
Brugia malayi	Latrophilin receptor protein 2	0.0196	0.2469	0.2469
Schistosoma mansoni	smad1 5 8 and	0.0051	0.0476	0.0825
Brugia malayi	Domain found in Dishevelled, Egl-10, and Pleckstrin family protein	0.0017	0.0017	0.0017
Loa Loa (eye worm)	MH1 domain-containing protein	0.0023	0.0091	0.0075
Brugia malayi	isocitrate dehydrogenase	0.0048	0.0432	0.0432
Schistosoma mansoni	tar DNA-binding protein	0.0326	0.4244	0.7585
Loa Loa (eye worm)	RNA binding protein	0.0326	0.4244	0.4234
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0165	0.0149
Brugia malayi	RNA binding protein	0.0326	0.4244	0.4244
Brugia malayi	hypothetical protein	0.0017	0.0017	0.0017
Echinococcus multilocularis	smad	0.0051	0.0476	0.1087
Echinococcus granulosus	GPCR family 2	0.0196	0.2469	0.5801
Echinococcus multilocularis	TGF beta signal transducer SmadC	0.0051	0.0476	0.1087
Schistosoma mansoni	smad	0.0051	0.0476	0.0825
Schistosoma mansoni	smad1 5 8 and	0.0051	0.0476	0.0825
Brugia malayi	MH1 domain containing protein	0.0028	0.0165	0.0165
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0048	0.0432	0.0982
Echinococcus granulosus	NADP dependent isocitrate dehydrogenase	0.0048	0.0432	0.0982
Mycobacterium tuberculosis	Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP)	0.0048	0.0432	0.5
Schistosoma mansoni	hypothetical protein	0.0196	0.2469	0.44
Echinococcus multilocularis	tar DNA binding protein	0.0326	0.4244	1
Brugia malayi	N-terminal motif family protein	0.0351	0.4589	0.4589
Schistosoma mansoni	TGF-beta signal transducer Smad2	0.0051	0.0476	0.0825
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0196	0.2469	0.5801
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0196	0.2469	0.5801
Brugia malayi	Calcitonin receptor-like protein seb-1	0.062	0.8278	0.8278
Schistosoma mansoni	tar DNA-binding protein	0.0326	0.4244	0.7585
Brugia malayi	mothers against decapentaplegic homolog 3	0.0023	0.0091	0.0091
Trypanosoma brucei	isocitrate dehydrogenase, putative	0.0048	0.0432	1
Schistosoma mansoni	hypothetical protein	0.0196	0.2469	0.44
Schistosoma mansoni	tar DNA-binding protein	0.0326	0.4244	0.7585
Schistosoma mansoni	Smad4	0.0023	0.0091	0.0134
Brugia malayi	TAR-binding protein	0.0326	0.4244	0.4244
Echinococcus granulosus	mothers against decapentaplegic 6	0.0023	0.0091	0.0176
Loa Loa (eye worm)	isocitrate dehydrogenase	0.0048	0.0432	0.0416
Loa Loa (eye worm)	MH2 domain-containing protein	0.0023	0.0091	0.0075
Echinococcus granulosus	Smad4	0.0051	0.0476	0.1087
Echinococcus granulosus	smad	0.0051	0.0476	0.1087
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.062	0.8278	0.8275
Plasmodium vivax	isocitrate dehydrogenase [NADP], mitochondrial, putative	0.0048	0.0432	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0121	0.0104
Brugia malayi	MH2 domain containing protein	0.0023	0.0091	0.0091
Loa Loa (eye worm)	MH2 domain-containing protein	0.0051	0.0476	0.046
Brugia malayi	Smad1	0.0051	0.0476	0.0476
Schistosoma mansoni	smad1 5 8 and	0.0051	0.0476	0.0825
Loa Loa (eye worm)	MH2 domain-containing protein	0.0746	1	1
Brugia malayi	RNA recognition motif domain containing protein	0.0326	0.4244	0.4244
Leishmania major	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0048	0.0432	1
Brugia malayi	latrophilin 2 splice variant baaae	0.0424	0.5589	0.5589
Brugia malayi	Domain found in Dishevelled, Egl-10, and Pleckstrin family protein	0.0017	0.0017	0.0017
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0326	0.4244	0.4234
Loa Loa (eye worm)	hypothetical protein	0.0351	0.4589	0.458
Schistosoma mansoni	hypothetical protein	0.0196	0.2469	0.44
Schistosoma mansoni	tar DNA-binding protein	0.0326	0.4244	0.7585
Loa Loa (eye worm)	TAR-binding protein	0.0326	0.4244	0.4234
Schistosoma mansoni	Smad4	0.0051	0.0476	0.0825
Schistosoma mansoni	tar DNA-binding protein	0.0326	0.4244	0.7585
Brugia malayi	MH1 domain containing protein	0.0051	0.0476	0.0476
Loa Loa (eye worm)	Smad1	0.0051	0.0476	0.046
Loa Loa (eye worm)	hypothetical protein	0.0196	0.2469	0.2456
Loa Loa (eye worm)	transcription factor SMAD2	0.0746	1	1
Loa Loa (eye worm)	nuclear factor I	0.0028	0.0165	0.0149
Brugia malayi	DIX domain containing protein	0.0017	0.0017	0.0017
Echinococcus granulosus	mothers against decapentaplegic 2	0.0023	0.0091	0.0176
Echinococcus multilocularis	GPCR, family 2	0.0196	0.2469	0.5801
Loa Loa (eye worm)	MH1 domain-containing protein	0.0051	0.0476	0.046
Echinococcus granulosus	mothers against decapentaplegic 5	0.0051	0.0476	0.1087
Brugia malayi	hypothetical protein	0.0017	0.0017	0.0017
Trypanosoma brucei	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0048	0.0432	1
Echinococcus multilocularis	isocitrate dehydrogenase	0.0048	0.0432	0.0982
Toxoplasma gondii	LsmAD domain-containing protein	0.0025	0.0121	0.251
Schistosoma mansoni	smad	0.0023	0.0091	0.0134
Echinococcus granulosus	tar DNA binding protein	0.0326	0.4244	1
Schistosoma mansoni	NADP-specific isocitrate dehydrogenase	0.0048	0.0432	0.0745
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0196	0.2469	0.2469
Brugia malayi	regulator of G-protein signaling egl-10	0.0017	0.0017	0.0017
Schistosoma mansoni	hypothetical protein	0.0196	0.2469	0.44
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0048	0.0432	0.0982
Toxoplasma gondii	isocitrate dehydrogenase	0.0048	0.0432	1
Echinococcus multilocularis	Smad4	0.0051	0.0476	0.1087
Brugia malayi	MH2 domain containing protein	0.0051	0.0476	0.0476
Schistosoma mansoni	hypothetical protein	0.0424	0.5589	1
Echinococcus multilocularis	mothers against decapentaplegic 6	0.0023	0.0091	0.0176
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0196	0.2469	0.2456
Echinococcus granulosus	TGF beta signal transducer SmadC	0.0051	0.0476	0.1087
Loa Loa (eye worm)	hypothetical protein	0.062	0.8278	0.8275
Onchocerca volvulus	Rap guanine nucleotide exchange factor 1 homolog	0.0351	0.4589	1
Echinococcus multilocularis	mothers against decapentaplegic 2	0.0023	0.0091	0.0176
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0196	0.2469	0.5801
Schistosoma mansoni	Smad4	0.0023	0.0091	0.0134
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0091	0.0075
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0048	0.0432	0.0982
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0196	0.2469	0.5801
Brugia malayi	MH2 domain containing protein	0.0051	0.0476	0.0476
Plasmodium falciparum	isocitrate dehydrogenase [NADP], mitochondrial	0.0048	0.0432	1
Brugia malayi	MH1 domain containing protein	0.0028	0.0165	0.0165
Onchocerca volvulus	Mothers against decapentaplegic homolog	0.0023	0.0091	0.0163
Brugia malayi	hypothetical protein	0.0025	0.0121	0.0121
Trypanosoma cruzi	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0048	0.0432	1
Echinococcus multilocularis	isocitrate dehydrogenase 2 (NADP+)	0.0048	0.0432	0.0982
Echinococcus multilocularis	mothers against decapentaplegic 5	0.0051	0.0476	0.1087

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 906190