TDR Targets

Basic information

Technical information

TDR Targets ID: 208217
Name: 5-thiophen-2-ylsulfonylthiophene-2-sulfonamid e
MW: 309.405 | Formula: C8H7NO4S4
H donors: 1 H acceptors: 4 LogP: 1.64 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: NS(=O)(=O)c1ccc(s1)S(=O)(=O)c1cccs1
InChi: 1S/C8H7NO4S4/c9-17(12,13)8-4-3-7(15-8)16(10,11)6-2-1-5-14-6/h1-5H,(H2,9,12,13)
InChiKey: PKSPQYUQOOXIOO-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

5-(2-thienylsulfonyl)thiophene-2-sulfonamide
5-(2-thienylsulfonyl)-2-thiophenesulfonamide

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)	aspartic protease BmAsp-2	0.0082	0.0188	0.0188
Schistosoma mansoni	integrin beta subunit	0.0179	0.0545	0.0545
Schistosoma mansoni	caspase-7 (C14 family)	0.0058	0.0099	0.0099
Schistosoma mansoni	transcription factor LCR-F1	0.007	0.0144	0.0144
Trypanosoma brucei	trypanothione reductase	0.0062	0.0115	0.0044
Mycobacterium leprae	RIBONUCLEOSIDE-DIPHOSPHATE REDUCTASE (ALPHA CHAIN) NRDE (RIBONUCLEOTIDE REDUCTASE SMALL SUBUNIT) (R1F PROTEIN)	0.239	0.8692	1
Brugia malayi	glutathione reductase	0.0062	0.0115	0.0115
Echinococcus granulosus	thioredoxin glutathione reductase	0.0062	0.0115	0.0115
Loa Loa (eye worm)	ribonucleoside-diphosphate reductase large subunit	0.2745	1	1
Loa Loa (eye worm)	ribonucleotide reductase M2 B	0.0148	0.0432	0.0432
Schistosoma mansoni	hypothetical protein	0.0184	0.0564	0.0564
Entamoeba histolytica	hypothetical protein	0.007	0.0144	0.5
Loa Loa (eye worm)	hypothetical protein	0.004	0.0035	0.0035
Echinococcus multilocularis	caspase 2	0.0058	0.0099	0.0099
Leishmania major	ribonucleoside-diphosphate reductase small chain, putative	0.0148	0.0432	0.032
Plasmodium falciparum	plasmepsin VI	0.0082	0.0188	0.0136
Plasmodium vivax	ribonucleoside-diphosphate reductase small chain, putative	0.0148	0.0432	0.0381
Leishmania major	ribonucleoside-diphosphate reductase small chain, putative	0.0148	0.0432	0.032
Toxoplasma gondii	aspartyl proteinase (eimepsin), putative	0.0082	0.0188	0.0136
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0056	0.0056
Toxoplasma gondii	ribonucleoside-diphosphate reductase small subunit	0.0148	0.0432	0.0381
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0053	0.0053
Trichomonas vaginalis	ribonucleoside-diphosphate reductase alpha chain, putative	0.239	0.8692	1
Onchocerca volvulus	Cell death protein 3 homolog	0.0058	0.0099	1
Brugia malayi	Integrin beta pat-3 precursor	0.0303	0.1004	0.1004
Brugia malayi	latrophilin 2 splice variant baaae	0.0066	0.0132	0.0132
Echinococcus granulosus	kelch ECH associated protein 1 like	0.0183	0.0562	0.0562
Loa Loa (eye worm)	hypothetical protein	0.0082	0.0188	0.0188
Schistosoma mansoni	hypothetical protein	0.004	0.0035	0.0035
Brugia malayi	hypothetical protein	0.0045	0.0053	0.0053
Plasmodium falciparum	plasmepsin II	0.0082	0.0188	0.0136
Echinococcus multilocularis	apoptotic protease activating factor 1	0.004	0.0035	0.0035
Brugia malayi	Cell death protein 3 precursor	0.0058	0.0099	0.0099
Plasmodium vivax	ribonucleotide reductase small subunit, putative	0.005	0.0071	0.0019
Plasmodium vivax	plasmepsin IV, putative	0.0082	0.0188	0.0136
Trypanosoma brucei	ribonucleoside-diphosphate reductase small chain	0.0148	0.0432	0.0363
Plasmodium falciparum	ribonucleoside-diphosphate reductase small chain, putative	0.005	0.0071	0.0019
Echinococcus multilocularis	integrin beta 2	0.0225	0.0714	0.0714
Mycobacterium ulcerans	ribonucleotide-diphosphate reductase subunit alpha	0.239	0.8692	1
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0062	0.0115	0.0115
Chlamydia trachomatis	transcriptional repressor NrdR	0.0355	0.1195	0.0797
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	0.0045	0.0053	0.0053
Loa Loa (eye worm)	thioredoxin reductase	0.0062	0.0115	0.0115
Entamoeba histolytica	hypothetical protein	0.007	0.0144	0.5
Schistosoma mansoni	hypothetical protein	0.007	0.0144	0.0144
Plasmodium falciparum	glutathione reductase	0.0062	0.0115	0.0063
Trypanosoma brucei	ribonucleoside-diphosphate reductase large chain	0.2745	1	1
Trypanosoma brucei	ribonucleoside-diphosphate reductase small chain	0.0148	0.0432	0.0363
Loa Loa (eye worm)	kelch domain-containing protein family protein	0.0046	0.0056	0.0056
Entamoeba histolytica	hypothetical protein	0.007	0.0144	0.5
Brugia malayi	Pepsin A precursor	0.0045	0.0053	0.0053
Schistosoma mansoni	intracisternal A-particle retropepsin (A02 family)	0.2455	0.8934	0.8934
Loa Loa (eye worm)	glutathione reductase	0.0062	0.0115	0.0115
Schistosoma mansoni	cathepsin D (A01 family)	0.0175	0.0533	0.0533
Brugia malayi	hypothetical protein	0.0046	0.0056	0.0056
Trypanosoma cruzi	ribonucleoside-diphosphate reductase large chain, putative	0.2745	1	1
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0053	0.0053
Loa Loa (eye worm)	hypothetical protein	0.0058	0.0099	0.0099
Onchocerca volvulus		0.0045	0.0053	0.2708
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	0.0045	0.0053	0.0053
Echinococcus granulosus	caspase 2	0.0058	0.0099	0.0099
Echinococcus multilocularis	kelch ECH associated protein 1	0.0183	0.0562	0.0562
Brugia malayi	ribonucleotide reductase 2	0.0148	0.0432	0.0432
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.007	0.0144	0.0144
Plasmodium falciparum	plasmepsin IV	0.0082	0.0188	0.0136
Mycobacterium leprae	conserved hypothetical protein	0.0355	0.1195	0.1303
Loa Loa (eye worm)	hypothetical protein	0.0066	0.0132	0.0132
Schistosoma mansoni	memapsin-2 (A01 family)	0.0851	0.3023	0.3023
Toxoplasma gondii	aspartyl protease ASP1	0.0082	0.0188	0.0136
Plasmodium falciparum	ribonucleoside-diphosphate reductase small chain, putative	0.0148	0.0432	0.0381
Loa Loa (eye worm)	aspartic protease BmAsp-1	0.0045	0.0053	0.0053
Echinococcus granulosus	apoptotic protease activating factor 1	0.004	0.0035	0.0035
Mycobacterium tuberculosis	Probable transcriptional regulatory protein NrdR	0.0355	0.1195	0.1258
Treponema pallidum	ribonucleotide-diphosphate reductase subunit alpha	0.2745	1	1
Mycobacterium tuberculosis	Ribonucleoside-diphosphate reductase (alpha chain) NrdE (ribonucleotide reductase small subunit) (R1F protein)	0.239	0.8692	1
Trypanosoma cruzi	ribonucleoside-diphosphate reductase small chain, putative	0.0148	0.0432	0.032
Mycobacterium ulcerans	transcriptional regulator NrdR	0.0355	0.1195	0.1303
Brugia malayi	Thioredoxin reductase	0.0062	0.0115	0.0115
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	0.0045	0.0053	0.0053
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	0.0045	0.0053	0.0053
Plasmodium falciparum	ribonucleoside-diphosphate reductase large subunit, putative	0.2745	1	1
Toxoplasma gondii	ribonucleoside-diphosphate reductase large chain	0.2745	1	1
Trypanosoma brucei	RNA helicase, putative	0.01	0.0255	0.0185
Chlamydia trachomatis	ribonucleoside-diphosphate reductase subunit alpha	0.2745	1	1
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	0.0045	0.0053	0.0053
Brugia malayi	aspartic protease BmAsp-2, identical	0.0045	0.0053	0.0053
Loa Loa (eye worm)	aspartyl protease 6	0.0045	0.0053	0.0053
Plasmodium vivax	thioredoxin reductase, putative	0.0062	0.0115	0.0063
Leishmania major	ribonucleoside-diphosphate reductase large chain, putative	0.2745	1	1
Wolbachia endosymbiont of Brugia malayi	ribonucleotide-diphosphate reductase subunit alpha	0.239	0.8692	1
Echinococcus granulosus	kelch ECH associated protein 1 like	0.0183	0.0562	0.0562
Trypanosoma brucei	ribonucleoside-diphosphate reductase small chain, putative	0.0148	0.0432	0.0363
Echinococcus granulosus	ribonucleoside diphosphate reductase large	0.2745	1	1
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.007	0.0144	0.0144
Plasmodium vivax	glutathione reductase, putative	0.0062	0.0115	0.0063
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0097	0.0245	0.0245
Trypanosoma brucei	ribonucleoside-diphosphate reductase small chain	0.0148	0.0432	0.0363
Echinococcus granulosus	integrin beta 2	0.0225	0.0714	0.0714
Brugia malayi	hypothetical protein	0.007	0.0144	0.0144
Plasmodium vivax	ribonucleoside-diphosphate reductase large chain, putative	0.2745	1	1
Echinococcus multilocularis	kelch ECH associated protein 1	0.0183	0.0562	0.0562
Schistosoma mansoni	hypothetical protein	0.0066	0.0132	0.0132
Schistosoma mansoni	serine-type protease inhibitor	0.0442	0.1516	0.1516
Echinococcus multilocularis	ribonucleoside diphosphate reductase subunit	0.0148	0.0432	0.0432
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	0.0045	0.0053	0.0053
Brugia malayi	Kelch motif family protein	0.0046	0.0056	0.0056
Loa Loa (eye worm)	integrin beta-2	0.0303	0.1004	0.1004
Entamoeba histolytica	hypothetical protein	0.007	0.0144	0.5
Schistosoma mansoni	ribonucleoside-diphosphate reductase small chain	0.0148	0.0432	0.0432
Plasmodium falciparum	thioredoxin reductase	0.0062	0.0115	0.0063
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	0.0082	0.0188	0.0188
Plasmodium falciparum	plasmepsin I	0.0082	0.0188	0.0136
Plasmodium vivax	aspartyl proteinase, putative	0.0082	0.0188	0.0136
Onchocerca volvulus		0.0045	0.0053	0.2708
Brugia malayi	Eukaryotic aspartyl protease family protein	0.0045	0.0053	0.0053
Toxoplasma gondii	thioredoxin reductase	0.0062	0.0115	0.0063
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	0.0045	0.0053	0.0053
Echinococcus multilocularis	Kelch repeat type 1	0.0184	0.0564	0.0564
Brugia malayi	hypothetical protein	0.0045	0.0053	0.0053
Brugia malayi	aspartic protease BmAsp-1, identical	0.0045	0.0053	0.0053
Schistosoma mansoni	ribonucleoside-diphosphate reductase alpha subunit	0.2745	1	1
Brugia malayi	hypothetical protein	0.004	0.0035	0.0035
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	0.0045	0.0053	0.0053
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0097	0.0245	0.0245
Schistosoma mansoni	hypothetical protein	0.01	0.0255	0.0255
Loa Loa (eye worm)	hypothetical protein	0.0097	0.0245	0.0245
Trypanosoma cruzi	ribonucleoside-diphosphate reductase small chain, putative	0.0148	0.0432	0.032
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0097	0.0245	0.0245
Echinococcus granulosus	ribonucleoside diphosphate reductase subunit	0.0148	0.0432	0.0432
Echinococcus granulosus	cathepsin d lysosomal aspartyl protease	0.0082	0.0188	0.0188
Schistosoma mansoni	serine-type protease inhibitor	0.0442	0.1516	0.1516
Mycobacterium tuberculosis	Ribonucleoside-diphosphate reductase (beta chain) NrdF1 (ribonucleotide reductase small subunit) (R2F protein)	0.0148	0.0432	0.0369
Mycobacterium tuberculosis	Probable ribonucleoside-diphosphate reductase (large subunit) NrdZ (ribonucleotide reductase)	0.0859	0.3052	0.3425
Mycobacterium tuberculosis	Ribonucleoside-diphosphate reductase (beta chain) NrdB (ribonucleotide reductase small chain)	0.0148	0.0432	0.0369
Echinococcus multilocularis	ribonucleoside diphosphate reductase large	0.2745	1	1
Echinococcus granulosus	kelch ECH associated protein 1	0.0183	0.0562	0.0562
Echinococcus multilocularis	cathepsin d (lysosomal aspartyl protease)	0.0082	0.0188	0.0188
Schistosoma mansoni	cathepsin D (A01 family)	0.0175	0.0533	0.0533
Trypanosoma cruzi	ribonucleoside-diphosphate reductase large chain, putative	0.0733	0.2588	0.2502
Schistosoma mansoni	family A2 unassigned peptidase (A02 family)	0.0446	0.1531	0.1531

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 9.09	Binding activity against human Carbonic anhydrase II (hCAII)	ChEMBL.	12166932
Log IC50 (binding)	= 9.09	Binding activity against human Carbonic anhydrase II (hCAII)	ChEMBL.	12166932

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

PubChem: 4116214

Bibliographic References

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 208217