TDR Targets

Basic information

Technical information

TDR Targets ID: 719851
Name: 1-(2-methoxy-4,5-dimethylphenyl)sulfonylpyrro lidine
MW: 269.36 | Formula: C13H19NO3S
H donors: 0 H acceptors: 2 LogP: 2.26 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: COc1cc(C)c(cc1S(=O)(=O)N1CCCC1)C
InChi: 1S/C13H19NO3S/c1-10-8-12(17-3)13(9-11(10)2)18(15,16)14-6-4-5-7-14/h8-9H,4-7H2,1-3H3
InChiKey: WVHBIUQUDOAWMX-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

1-(2-methoxy-4,5-dimethyl-phenyl)sulfonylpyrrolidine
ZINC00610946
T5576033

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
Trichomonas vaginalis	malate dehydrogenase, putative	0.0042	0.0363	1
Trichomonas vaginalis	malate and lactate dehydrogenase, putative	0.0042	0.0363	1
Mycobacterium tuberculosis	Probable 1-deoxy-D-xylulose 5-phosphate reductoisomerase Dxr (DXP reductoisomerase) (1-deoxyxylulose-5-phosphate reductoisomeras	0.0103	0.1287	1
Trichomonas vaginalis	malate dehydrogenase, putative	0.0033	0.0225	0.6181
Echinococcus granulosus	regulator of G protein signaling 7	0.0019	0.0005	0.0005
Mycobacterium tuberculosis	Probable malate dehydrogenase Mdh	0.0042	0.0363	0.2823
Plasmodium falciparum	1-deoxy-D-xylulose 5-phosphate reductoisomerase	0.0427	0.6236	1
Mycobacterium ulcerans	malate dehydrogenase	0.0042	0.0363	0.0583
Loa Loa (eye worm)	RGS-3 protein	0.0019	0.0005	0.0057
Echinococcus multilocularis	A kinase anchor protein 10, mitochondrial	0.0019	0.0005	0.0005
Brugia malayi	PXA domain containing protein	0.0019	0.0005	0.0057
Toxoplasma gondii	ribonuclease HI protein	0.0021	0.0046	0.0073
Mycobacterium leprae	PROBABLE 1-DEOXY-D-XYLULOSE 5-PHOSPHATE REDUCTOISOMERASE DXR (DXP REDUCTOISOMERASE) (1-DEOXYXYLULOSE-5-PHOSPHATE REDUCTOISOMERAS	0.0427	0.6236	1
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0005	0.0057
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0005	0.0057
Schistosoma mansoni	z-protein (S1r protein)	0.0019	0.0005	0.0005
Trypanosoma brucei	unspecified product	0.0023	0.0073	0.078
Entamoeba histolytica	malate dehydrogenase, putative	0.0042	0.0363	1
Brugia malayi	regulator of G-protein signaling rgs-7	0.0019	0.0005	0.0057
Schistosoma mansoni	regulator of G protein signaling 17 19 20 (rgs17 19 20)	0.0019	0.0005	0.0005
Echinococcus multilocularis	regulator of G protein signaling 7	0.0019	0.0005	0.0005
Echinococcus multilocularis	axis inhibition protein axin	0.0019	0.0005	0.0005
Schistosoma mansoni	malate dehydrogenase	0.0042	0.0363	0.0363
Echinococcus granulosus	regulator of G protein signaling 7	0.0019	0.0005	0.0005
Trypanosoma cruzi	cytosolic malate dehydrogenase, putative	0.0042	0.0363	1
Trichomonas vaginalis	malate and lactate dehydrogenase, putative	0.0042	0.0363	1
Echinococcus multilocularis	expressed protein	0.0364	0.528	0.528
Loa Loa (eye worm)	AGC/GRK/GRK protein kinase	0.0019	0.0005	0.0057
Trypanosoma brucei	hypothetical protein, conserved	0.0023	0.0073	0.078
Trypanosoma brucei	ingi protein (ORF1)	0.0023	0.0073	0.078
Loa Loa (eye worm)	G protein signaling regulator EGL-10	0.0019	0.0005	0.0057
Brugia malayi	hypothetical protein	0.0019	0.0005	0.0057
Wolbachia endosymbiont of Brugia malayi	1-deoxy-D-xylulose 5-phosphate reductoisomerase	0.0427	0.6236	1
Echinococcus multilocularis	regulator of G protein signaling 3	0.0019	0.0005	0.0005
Giardia lamblia	Malate dehydrogenase	0.0042	0.0363	1
Brugia malayi	RNase H family protein	0.0021	0.0046	0.048
Echinococcus multilocularis	EGFP:Bcl2 fusion protein	0.0081	0.0953	0.0953
Echinococcus multilocularis	beta adrenergic receptor kinase	0.0019	0.0005	0.0005
Trichomonas vaginalis	malate dehydrogenase, putative	0.0042	0.0363	1
Brugia malayi	Probable G protein-coupled receptor kinase F19C6.1, putative	0.0019	0.0005	0.0057
Trypanosoma cruzi	ribonuclease H1, putative	0.0021	0.0046	0.1259
Schistosoma mansoni	phosphoglucomutase	0.0021	0.0046	0.0046
Leishmania major	ribonuclease H1, putative	0.0021	0.0046	0.1259
Echinococcus multilocularis	cytosolic malate dehydrogenase	0.0042	0.0363	0.0363
Echinococcus granulosus	expressed protein	0.0364	0.528	0.528
Trichomonas vaginalis	malate dehydrogenase, putative	0.0042	0.0363	1
Brugia malayi	Regulator of G protein signaling domain containing protein	0.0019	0.0005	0.0057
Echinococcus multilocularis	ribonuclease H1	0.0021	0.0046	0.0046
Echinococcus multilocularis	microtubule associated protein 2	0.0673	1	1
Schistosoma mansoni	regulator of G protein signaling	0.0019	0.0005	0.0005
Loa Loa (eye worm)	apoptosis regulator protein	0.0081	0.0953	1
Trichomonas vaginalis	malate dehydrogenase, putative	0.0042	0.0363	1
Schistosoma mansoni	axis inhibition protein axin	0.0019	0.0005	0.0005
Wolbachia endosymbiont of Brugia malayi	ribonuclease HI	0.0021	0.0046	0.0073
Trypanosoma brucei	cytosolic malate dehydrogenase	0.0042	0.0363	0.3857
Giardia lamblia	Ribonuclease H	0.0021	0.0046	0.1259
Brugia malayi	Regulator of G protein signaling domain containing protein	0.0019	0.0005	0.0057
Entamoeba histolytica	hypothetical protein	0.0019	0.0005	0.0149
Echinococcus multilocularis	axis inhibition protein axin	0.0019	0.0005	0.0005
Schistosoma mansoni	serine/threonine protein kinase	0.0019	0.0005	0.0005
Brugia malayi	hypothetical protein	0.0019	0.0005	0.0057
Trichomonas vaginalis	conserved hypothetical protein	0.0019	0.0005	0.0149
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0005	0.0057
Trypanosoma brucei	ingi protein (ORF1)	0.0023	0.0073	0.078
Echinococcus granulosus	ribonuclease H1	0.0021	0.0046	0.0046
Echinococcus multilocularis	cytosolic malate dehydrogenase	0.0042	0.0363	0.0363
Trichomonas vaginalis	malate dehydrogenase, putative	0.0042	0.0363	1
Schistosoma mansoni	regulator of G protein signaling	0.0019	0.0005	0.0005
Schistosoma mansoni	apoptosis regulator bax	0.0081	0.0953	0.0953
Schistosoma mansoni	regulator of G protein signaling	0.0019	0.0005	0.0005
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0005	0.0057
Schistosoma mansoni	malate dehydrogenase	0.0042	0.0363	0.0363
Echinococcus granulosus	axis inhibition protein axin	0.0019	0.0005	0.0005
Loa Loa (eye worm)	hypothetical protein	0.0081	0.0953	1
Echinococcus granulosus	regulator of G protein signaling 3	0.0019	0.0005	0.0005
Treponema pallidum	ribonuclease H (rnhA)	0.0021	0.0046	0.0073
Loa Loa (eye worm)	malate dehydrogenase	0.0042	0.0363	0.3811
Trypanosoma brucei	RNA helicase, putative	0.008	0.0942	1
Brugia malayi	RNase H family protein	0.0021	0.0046	0.048
Onchocerca volvulus	Ribonuclease H1 homolog	0.0021	0.0046	0.5
Schistosoma mansoni	hypothetical protein	0.008	0.0942	0.0942
Loa Loa (eye worm)	AGC/GRK/BARK protein kinase	0.0019	0.0005	0.0057
Trypanosoma brucei	ribonuclease H1	0.0021	0.0046	0.0486
Schistosoma mansoni	hypothetical protein	0.0081	0.0953	0.0953
Trypanosoma brucei	retrotransposon hot spot protein 4 (RHS4), interrupted	0.0023	0.0073	0.078
Echinococcus granulosus	axis inhibition protein axin	0.0019	0.0005	0.0005
Brugia malayi	RNase H family protein	0.0021	0.0046	0.048
Schistosoma mansoni	regulator of G protein signaling 3 rgs3	0.0019	0.0005	0.0005
Schistosoma mansoni	bcl-2 homologous antagonist/killer (bak)	0.0081	0.0953	0.0953
Trypanosoma cruzi	ribonuclease H1, putative	0.0021	0.0046	0.1259
Brugia malayi	PXA domain containing protein	0.0019	0.0005	0.0057
Echinococcus granulosus	beta-adrenergic receptor kinase	0.0019	0.0005	0.0005
Trypanosoma cruzi	cytosolic malate dehydrogenase, putative	0.0042	0.0363	1
Trichomonas vaginalis	conserved hypothetical protein	0.0019	0.0005	0.0149
Echinococcus multilocularis	Regulator of G protein signaling 20	0.0019	0.0005	0.0005
Trichomonas vaginalis	regulator of G protein signaling 5, rgs5, putative	0.0019	0.0005	0.0149
Schistosoma mansoni	serine/threonine protein kinase	0.0019	0.0005	0.0005
Echinococcus granulosus	Bcl 2 ous antagonist:killer	0.0081	0.0953	0.0953
Entamoeba histolytica	malate dehydrogenase,cytoplasmic, putative	0.0042	0.0363	1
Echinococcus granulosus	A kinase anchor protein 10 mitochondrial	0.0019	0.0005	0.0005
Trichomonas vaginalis	malate dehydrogenase, putative	0.0042	0.0363	1
Trichomonas vaginalis	malate dehydrogenase, putative	0.0042	0.0363	1
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0005	0.0057
Chlamydia trachomatis	1-deoxy-D-xylulose 5-phosphate reductoisomerase	0.0427	0.6236	1
Schistosoma mansoni	hypothetical protein	0.0081	0.0953	0.0953
Echinococcus multilocularis	regulator of G protein signaling 7	0.0019	0.0005	0.0005
Brugia malayi	Malate dehydrogenase, cytoplasmic	0.0042	0.0363	0.3811
Loa Loa (eye worm)	PXA domain-containing protein	0.0019	0.0005	0.0057
Trichomonas vaginalis	malate dehydrogenase, putative	0.0042	0.0363	1
Schistosoma mansoni	phosphoglucomutase	0.0021	0.0046	0.0046
Schistosoma mansoni	serine/threonine protein kinase	0.0019	0.0005	0.0005
Trichomonas vaginalis	malate dehydrogenase, putative	0.0042	0.0363	1
Schistosoma mansoni	regulator of G protein signaling	0.0019	0.0005	0.0005
Echinococcus multilocularis	Bcl 2 ous antagonist:killer	0.0081	0.0953	0.0953
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0005	0.0057
Entamoeba histolytica	hypothetical protein	0.0019	0.0005	0.0149
Schistosoma mansoni	regulator of G protein signaling	0.0019	0.0005	0.0005
Trichomonas vaginalis	malate and lactate dehydrogenase, putative	0.0042	0.0363	1
Echinococcus granulosus	regulator of G protein signaling 3	0.0019	0.0005	0.0005
Schistosoma mansoni	microtubule-associated protein tau	0.0673	1	1
Trichomonas vaginalis	malate and lactate dehydrogenase, putative	0.0042	0.0363	1
Brugia malayi	regulator of G-protein signaling egl-10	0.0019	0.0005	0.0057
Treponema pallidum	1-deoxy-D-xylulose 5-phosphate reductoisomerase	0.0427	0.6236	1
Trichomonas vaginalis	conserved hypothetical protein	0.0019	0.0005	0.0149
Trichomonas vaginalis	conserved hypothetical protein	0.0019	0.0005	0.0149
Schistosoma mansoni	phosphoglucomutase	0.0021	0.0046	0.0046
Trichomonas vaginalis	conserved hypothetical protein	0.0019	0.0005	0.0149
Mycobacterium ulcerans	1-deoxy-D-xylulose 5-phosphate reductoisomerase	0.0427	0.6236	1
Trichomonas vaginalis	malate dehydrogenase, putative	0.0042	0.0363	1
Plasmodium vivax	1-deoxy-D-xylulose 5-phosphate reductoisomerase, putative	0.0427	0.6236	1
Echinococcus multilocularis	regulator of G protein signaling	0.0019	0.0005	0.0005
Toxoplasma gondii	1-deoxy-D-xylulose 5-phosphate reductoisomerase, putative	0.0427	0.6236	1
Echinococcus granulosus	cytosolic malate dehydrogenase	0.0042	0.0363	0.0363
Entamoeba histolytica	hypothetical protein	0.0019	0.0005	0.0149
Leishmania major	cytosolic malate dehydrogenase	0.0042	0.0363	1
Echinococcus granulosus	cytosolic malate dehydrogenase	0.0042	0.0363	0.0363
Trichomonas vaginalis	malate dehydrogenase, putative	0.0042	0.0363	1
Trichomonas vaginalis	conserved hypothetical protein	0.0019	0.0005	0.0149
Echinococcus multilocularis	regulator of G protein signaling 3	0.0019	0.0005	0.0005
Echinococcus granulosus	EGFP:Bcl2 fusion protein	0.0081	0.0953	0.0953
Schistosoma mansoni	regulator of G protein signaling 17 19 20 (rgs17 19 20)	0.0019	0.0005	0.0005
Schistosoma mansoni	axis inhibition protein axin	0.0019	0.0005	0.0005
Schistosoma mansoni	hypothetical protein	0.0081	0.0953	0.0953
Trichomonas vaginalis	ribonuclease H1, putative	0.0021	0.0046	0.1259
Echinococcus granulosus	Regulator of G protein signaling 20	0.0019	0.0005	0.0005
Brugia malayi	Apoptosis regulator proteins, Bcl-2 family protein	0.0081	0.0953	1
Brugia malayi	A-kinase anchor protein 10, precursor	0.0019	0.0005	0.0057

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 719851