TDR Targets

Basic information

Technical information

TDR Targets ID: 690783
Name: N'-(3,4-dimethoxyphenyl)-N-[2-(4-dimethylamin ophenyl)-2-pyrrolidin-1-ylethyl]oxamide
MW: 440.535 | Formula: C24H32N4O4
H donors: 2 H acceptors: 2 LogP: 2.93 Rotable bonds: 11
Rule of 5 violations (Lipinski): 1
SMILES: COc1ccc(cc1OC)NC(=O)C(=O)NCC(c1ccc(cc1)N(C)C)N1CCCC1
InChi: 1S/C24H32N4O4/c1-27(2)19-10-7-17(8-11-19)20(28-13-5-6-14-28)16-25-23(29)24(30)26-18-9-12-21(31-3)22(15-18)32-4/h7-12,15,20H,5-6,13-14,16H2,1-4H3,(H,25,29)(H,26,30)
InChiKey: DLHBESYBTKFBRN-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'-(3,4-dimethoxyphenyl)-N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]oxamide
N'-(3,4-dimethoxyphenyl)-N-[2-(4-dimethylaminophenyl)-2-1-pyrrolidinylethyl]oxamide
N'-(3,4-dimethoxyphenyl)-N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]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
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.001	0.0145	0.0208
Loa Loa (eye worm)	O-glycosyl hydrolase family 30 protein	0.0255	0.6276	1
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.001	0.0145	0.013
Loa Loa (eye worm)	hypothetical protein	0.001	0.0145	0.0208
Trichomonas vaginalis	glucosylceramidase, putative	0.0167	0.4083	0.6472
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0009	0.0118	0.0103
Trichomonas vaginalis	glucosylceramidase, putative	0.0255	0.6276	1
Brugia malayi	RNA recognition motif domain containing protein	0.0063	0.1465	0.2317
Echinococcus granulosus	mixed lineage leukemia protein mll	0.0007	0.0074	0.006
Schistosoma mansoni	hypothetical protein	0.0403	1	1
Trichomonas vaginalis	glucosylceramidase, putative	0.0255	0.6276	1
Echinococcus multilocularis	FTZ F1 alpha	0.001	0.0145	0.013
Brugia malayi	steroid hormone receptor	0.001	0.0145	0.0208
Trichomonas vaginalis	ap endonuclease, putative	0.0019	0.0363	0.0489
Entamoeba histolytica	serine/threonine protein kinase, putative	0.012	0.2898	1
Echinococcus multilocularis	mixed lineage leukemia protein mll	0.0007	0.0074	0.006
Echinococcus multilocularis	tar DNA binding protein	0.0063	0.1465	0.1453
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.001	0.0145	0.0208
Plasmodium falciparum	NIMA related kinase 4	0.012	0.2898	1
Echinococcus granulosus	geminin	0.0165	0.403	0.4021
Trichomonas vaginalis	CAMK family protein kinase	0.012	0.2898	0.4566
Trichomonas vaginalis	ap endonuclease, putative	0.0019	0.0363	0.0489
Trichomonas vaginalis	glucosylceramidase, putative	0.0255	0.6276	1
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0019	0.0363	0.0349
Trichomonas vaginalis	glucosylceramidase, putative	0.0255	0.6276	1
Trichomonas vaginalis	STE family protein kinase	0.012	0.2898	0.4566
Trypanosoma cruzi	Serine/threonine-protein kinase NEK16, putative	0.012	0.2898	1
Schistosoma mansoni	tar DNA-binding protein	0.0063	0.1465	0.1465
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.001	0.0145	0.0208
Schistosoma mansoni	nuclear receptor	0.0005	0.0015	0.0015
Schistosoma mansoni	hypothetical protein	0.0122	0.2968	0.2968
Trichomonas vaginalis	glucosylceramidase, putative	0.0255	0.6276	1
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.001	0.0145	0.0145
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0007	0.0074	0.006
Trichomonas vaginalis	glucosylceramidase, putative	0.0167	0.4083	0.6472
Trichomonas vaginalis	glucosylceramidase, putative	0.0167	0.4083	0.6472
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	0.0019	0.0363	0.5
Brugia malayi	Nuclear hormone receptor-like 1	0.001	0.0145	0.0208
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.001	0.0145	0.0208
Leishmania major	protein kinase, putative	0.012	0.2898	1
Brugia malayi	CXXC zinc finger family protein	0.0028	0.0608	0.0947
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0005	0.0028	0.0028
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.001	0.0145	0.013
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0005	0.0028	0.0014
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.001	0.0145	0.013
Loa Loa (eye worm)	hypothetical protein	0.0005	0.0028	0.0022
Schistosoma mansoni	thyroid hormone receptor	0.0132	0.3214	0.3214
Brugia malayi	F/Y-rich N-terminus family protein	0.0009	0.0115	0.016
Brugia malayi	Steroid receptor seven-up type 2	0.001	0.0145	0.0208
Trypanosoma brucei	Serine/threonine-protein kinase NEK16, putative	0.012	0.2898	1
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0005	0.0028	0.0022
Loa Loa (eye worm)	hypothetical protein	0.001	0.0145	0.0208
Schistosoma mansoni	tar DNA-binding protein	0.0063	0.1465	0.1465
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.001	0.0145	0.0208
Echinococcus multilocularis	serine:threonine protein kinase Nek1	0.0117	0.2822	0.2811
Schistosoma mansoni	tar DNA-binding protein	0.0063	0.1465	0.1465
Loa Loa (eye worm)	TAR-binding protein	0.0063	0.1465	0.2317
Brugia malayi	O-Glycosyl hydrolase family 30 protein	0.0255	0.6276	1
Brugia malayi	nuclear hormone receptor	0.001	0.0145	0.0208
Onchocerca volvulus	Bile acid receptor homolog	0.001	0.0145	0.032
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.001	0.0145	0.0145
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0005	0.0028	0.0014
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.001	0.0145	0.0208
Echinococcus multilocularis	dnaJ subfamily B	0.0403	1	1
Loa Loa (eye worm)	hypothetical protein	0.001	0.0145	0.0208
Echinococcus granulosus	serine:threonine protein kinase Nek1	0.0117	0.2822	0.2811
Echinococcus granulosus	ecdysone induced protein 78C	0.001	0.0145	0.013
Echinococcus multilocularis	geminin	0.0165	0.403	0.4021
Schistosoma mansoni	hypothetical protein	0.0165	0.403	0.403
Trichomonas vaginalis	CAMK family protein kinase	0.012	0.2898	0.4566
Schistosoma mansoni	tar DNA-binding protein	0.0063	0.1465	0.1465
Toxoplasma gondii	NEK kinase	0.012	0.2898	1
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0063	0.1465	0.2317
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.001	0.0145	0.0145
Trichomonas vaginalis	glucosylceramidase, putative	0.0167	0.4083	0.6472
Trypanosoma cruzi	Serine/threonine-protein kinase NEK11, putative	0.012	0.2898	1
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0007	0.0074	0.006
Schistosoma mansoni	tar DNA-binding protein	0.0063	0.1465	0.1465
Schistosoma mansoni	hypothetical protein	0.0165	0.403	0.403
Trypanosoma cruzi	NIMA-related kinase, putative	0.012	0.2898	1
Leishmania major	serine/threonine-protein kinase, putative	0.012	0.2898	1
Schistosoma mansoni	nuclear hormone receptor	0.0005	0.0015	0.0015
Echinococcus granulosus	cpg binding protein	0.003	0.0648	0.0634
Loa Loa (eye worm)	hypothetical protein	0.001	0.0145	0.0208
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.001	0.0145	0.013
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0019	0.0363	0.0556
Brugia malayi	nuclear receptor RXR	0.0005	0.0028	0.0022
Brugia malayi	ecdysteroid receptor	0.001	0.0145	0.0208
Echinococcus granulosus	Mitotic checkpoint protein PRCC C terminal	0.0122	0.2968	0.2958
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.001	0.0145	0.032
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.001	0.0145	0.0208
Schistosoma mansoni	serine/threonine protein kinase	0.012	0.2898	0.2898
Schistosoma mansoni	nuclear hormone receptor	0.001	0.0145	0.0145
Onchocerca volvulus	Protein ultraspiracle homolog	0.001	0.0145	0.032
Brugia malayi	TAR-binding protein	0.0063	0.1465	0.2317
Schistosoma mansoni	cpg binding protein	0.003	0.0648	0.0648
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.001	0.0145	0.0208
Trichomonas vaginalis	glucosylceramidase, putative	0.0167	0.4083	0.6472
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.001	0.0145	0.0145
Leishmania major	protein kinase, putative,serine/threonine-protein kinase Nek1, putative	0.012	0.2898	1
Loa Loa (eye worm)	hypothetical protein	0.001	0.0145	0.0208
Brugia malayi	Nuclear hormone receptor-like 1	0.0005	0.0028	0.0022
Echinococcus multilocularis	Mitotic checkpoint protein PRCC, C terminal	0.0122	0.2968	0.2958
Loa Loa (eye worm)	hypothetical protein	0.001	0.0145	0.0208
Brugia malayi	hypothetical protein	0.0005	0.0028	0.0022
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.001	0.0145	0.013
Trichomonas vaginalis	CAMK family protein kinase	0.012	0.2898	0.4566
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.006	0.1403	0.1403
Schistosoma mansoni	zinc finger protein	0.0005	0.0015	0.0015
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.001	0.0145	0.013
Schistosoma mansoni	RAR-like nuclear receptor	0.001	0.0145	0.0145
Loa Loa (eye worm)	RNA binding protein	0.0063	0.1465	0.2317
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.001	0.0145	0.013
Loa Loa (eye worm)	hypothetical protein	0.0005	0.0028	0.0022
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.001	0.0145	0.0208
Echinococcus multilocularis	cpg binding protein	0.003	0.0648	0.0634
Schistosoma mansoni	ap endonuclease	0.0019	0.0363	0.0363
Trichomonas vaginalis	CAMK family protein kinase	0.012	0.2898	0.4566
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.0005	0.0015	0.0015
Schistosoma mansoni	steroid hormone receptor ad4bp	0.001	0.0145	0.0145
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.001	0.0145	0.013
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0009	0.0118	0.0103
Brugia malayi	exodeoxyribonuclease III family protein	0.0019	0.0363	0.0556
Loa Loa (eye worm)	steroid hormone receptor	0.001	0.0145	0.0208
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0028	0.0608	0.0947
Plasmodium vivax	serine/threonine-protein kinase NEK4, putative	0.012	0.2898	1
Schistosoma mansoni	nuclear hormone receptor	0.0005	0.0015	0.0015
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0054	0.1242	0.3468
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.001	0.0145	0.013
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.001	0.0145	0.0208
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.001	0.0145	0.013
Schistosoma mansoni	ap endonuclease	0.0019	0.0363	0.0363
Trypanosoma cruzi	Serine/threonine-protein kinase NEK11, putative	0.012	0.2898	1
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.001	0.0145	0.0145
Trypanosoma brucei	NIMA-related protein kinase	0.012	0.2898	1
Echinococcus granulosus	tar DNA binding protein	0.0063	0.1465	0.1453
Plasmodium falciparum	NIMA related kinase 2	0.012	0.2898	1
Trichomonas vaginalis	glucosylceramidase, putative	0.0255	0.6276	1
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.001	0.0145	0.0208
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.001	0.0145	0.0208
Trichomonas vaginalis	glucosylceramidase, putative	0.0167	0.4083	0.6472
Echinococcus granulosus	FTZ F1 alpha	0.001	0.0145	0.013
Toxoplasma gondii	NEK kinase	0.012	0.2898	1
Loa Loa (eye worm)	hypothetical protein	0.0005	0.0028	0.0022
Brugia malayi	Nuclear hormone receptor-like 1	0.0005	0.0028	0.0022
Trichomonas vaginalis	glucosylceramidase, putative	0.0167	0.4083	0.6472
Brugia malayi	photoreceptor-specific nuclear receptor	0.001	0.0145	0.0208
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.0005	0.0015	0.0015
Loa Loa (eye worm)	hypothetical protein	0.001	0.0145	0.0208
Plasmodium vivax	serine/threonine-protein kinase Nek1, putative	0.012	0.2898	1
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0007	0.0074	0.0074
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0019	0.0363	0.0349
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.001	0.0145	0.0208
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.001	0.0145	0.0208
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.001	0.0145	0.0145
Toxoplasma gondii	NEK kinase	0.012	0.2898	1
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.001	0.0145	0.0208
Schistosoma mansoni	coup transcription factor	0.001	0.0145	0.0145
Loa Loa (eye worm)	histone methyltransferase	0.0009	0.0118	0.0165
Onchocerca volvulus		0.0028	0.0608	0.1458
Schistosoma mansoni	thyroid hormone receptor	0.0132	0.3214	0.3214
Schistosoma mansoni	retinoic acid receptor RXR	0.001	0.0145	0.0145
Trypanosoma brucei	Serine/threonine-protein kinase NEK11, putative	0.012	0.2898	1
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	0.0019	0.0363	0.5
Schistosoma mansoni	nuclear receptor	0.0005	0.0015	0.0015
Brugia malayi	nuclear receptor NHR-88	0.001	0.0145	0.0208
Onchocerca volvulus		0.001	0.0145	0.032
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.001	0.0145	0.0208
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.001	0.0145	0.0208
Trichomonas vaginalis	glucosylceramidase, putative	0.0176	0.4308	0.6835
Echinococcus multilocularis	ecdysone induced protein 78C	0.001	0.0145	0.013
Schistosoma mansoni	cpg binding protein	0.003	0.0648	0.0648
Trypanosoma cruzi	protein kinase, putative	0.0117	0.2822	0.9699
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.001	0.0145	0.013
Brugia malayi	hypothetical protein	0.0005	0.0028	0.0022
Loa Loa (eye worm)	hypothetical protein	0.0005	0.0028	0.0022
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0005	0.0028	0.0028
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.001	0.0145	0.013
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.001	0.0145	0.013
Schistosoma mansoni	nuclear receptor nhr-48	0.0005	0.0015	0.0015
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0019	0.0363	0.5
Trichomonas vaginalis	glucosylceramidase, putative	0.0176	0.4308	0.6835
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0019	0.0363	0.5
Schistosoma mansoni	cpg binding protein	0.0028	0.0608	0.0608
Loa Loa (eye worm)	hypothetical protein	0.0005	0.0028	0.0022
Brugia malayi	RNA binding protein	0.0063	0.1465	0.2317
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.001	0.0145	0.0208
Giardia lamblia	Kinase, NEK	0.012	0.2898	1
Loa Loa (eye worm)	hypothetical protein	0.001	0.0145	0.0208
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.001	0.0145	0.0208
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0132	0.3214	0.3204
Onchocerca volvulus	Glucosylceramidase homolog	0.0167	0.4083	1
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.001	0.0145	0.0208

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 690783