TDR Targets

Basic information

Technical information

TDR Targets ID: 72241
Name: 3,4-dichloro-N-(4-chloro-3-nitrophenyl)benzen esulfonamide
MW: 381.619 | Formula: C12H7Cl3N2O4S
H donors: 1 H acceptors: 4 LogP: 4.16 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: Clc1ccc(cc1Cl)S(=O)(=O)Nc1ccc(c(c1)[N+](=O)[O-])Cl
InChi: 1S/C12H7Cl3N2O4S/c13-9-4-2-8(6-11(9)15)22(20,21)16-7-1-3-10(14)12(5-7)17(18)19/h1-6,16H
InChiKey: LXDSFANEWMOXAG-UHFFFAOYSA-N

Network

Hover on a compound node to display the structore

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

This is a work in progress. Come back soon to try this features!

Clustering layers

This is a work in progress. Come back soon to try this features!

Synonyms

3,4-dichloro-N-(4-chloro-3-nitro-phenyl)benzenesulfonamide
ZINC07428280

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	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1952	0.4377	1
Giardia lamblia	Cathepsin B precursor	0.1479	0.291	1
Leishmania major	cathepsin L-like protease	0.2453	0.5928	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.2453	0.5928	1
Giardia lamblia	Dipeptidyl-peptidase I precursor	0.0679	0.0432	0.1483
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.2453	0.5928	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.2453	0.5928	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1071	0.1648	0.3517
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1952	0.4377	1
Brugia malayi	Papain family cysteine protease containing protein	0.1952	0.4377	0.4239
Echinococcus granulosus	cathepsin b	0.3767	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1952	0.4377	1
Onchocerca volvulus		0.1952	0.4377	1
Trypanosoma cruzi	cruzipain precursor, putative	0.2453	0.5928	0.5827
Giardia lamblia	Cathepsin B precursor	0.0697	0.0488	0.1677
Plasmodium falciparum	cysteine proteinase falcipain 3	0.1952	0.4377	1
Trypanosoma brucei	cysteine peptidase C (CPC)	0.1479	0.291	0.295
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.1952	0.4377	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1952	0.4377	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0697	0.0488	0.0761
Onchocerca volvulus		0.1952	0.4377	1
Echinococcus granulosus	cathepsin L cysteine proteinase	0.1952	0.4377	0.3268
Plasmodium vivax	unspecified product	0.0617	0.0241	0.055
Trypanosoma cruzi	cysteine peptidase, putative	0.2453	0.5928	0.5827
Loa Loa (eye worm)	hypothetical protein	0.1335	0.2465	0.2279
Echinococcus granulosus	cathepsin l1	0.1952	0.4377	0.3268
Loa Loa (eye worm)	hypothetical protein	0.3767	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.2453	0.5928	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1952	0.4377	1
Loa Loa (eye worm)	cathepsin B	0.1479	0.291	0.2736
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1952	0.4377	1
Trypanosoma cruzi	cysteine protease, putative	0.1071	0.1648	0.1442
Brugia malayi	Cathepsin L-like cysteine proteinase	0.1335	0.2465	0.2279
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0697	0.0488	0.0761
Trypanosoma cruzi	cysteine peptidase, putative	0.1071	0.1648	0.1442
Echinococcus multilocularis	cysteine protease	0.1952	0.4377	0.3268
Plasmodium falciparum	cysteine proteinase falcipain 1	0.1071	0.1648	0.3765
Plasmodium vivax	vivapain-2	0.1952	0.4377	1
Echinococcus multilocularis	cathepsin L cysteine protease	0.1952	0.4377	0.3268
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.1952	0.4377	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.2453	0.5928	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1952	0.4377	1
Toxoplasma gondii	cathepsin CPC1	0.0679	0.0432	0.0986
Loa Loa (eye worm)	hypothetical protein	0.1952	0.4377	0.4239
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.3767	1	1
Trypanosoma cruzi	cysteine proteinase, putative	0.1071	0.1648	0.1442
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.1952	0.4377	1
Loa Loa (eye worm)	ctsf protein	0.1952	0.4377	0.4239
Leishmania major	cathepsin L-like protease	0.1952	0.4377	0.4862
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.1836	0.4016	0.3868
Leishmania major	cysteine peptidase A (CPA)	0.1952	0.4377	0.4862
Leishmania major	cathepsin L-like protease	0.2453	0.5928	1
Brugia malayi	Cathepsin L-like precursor	0.1952	0.4377	0.4239
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1952	0.4377	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1952	0.4377	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1335	0.2465	0.5458
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0697	0.0488	0.0761
Brugia malayi	cathepsin L-like precursor	0.1335	0.2465	0.2279
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.1479	0.291	0.6515
Onchocerca volvulus		0.1952	0.4377	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1952	0.4377	1
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.1952	0.4377	0.3268
Plasmodium vivax	unspecified product	0.1071	0.1648	0.3765
Plasmodium vivax	vivapain-1	0.1071	0.1648	0.3765
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.1071	0.1648	0.1442
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.2453	0.5928	1
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.1479	0.291	0.2736
Loa Loa (eye worm)	hypothetical protein	0.1335	0.2465	0.2279
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1952	0.4377	1
Plasmodium vivax	dipeptidyl aminopeptidase 1, putative	0.0679	0.0432	0.0986
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.1071	0.1648	0.1442
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1952	0.4377	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1071	0.1648	0.3517
Toxoplasma gondii	cathepsin B	0.1479	0.291	0.6649
Giardia lamblia	Cathepsin B precursor	0.1479	0.291	1
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.1952	0.4377	0.4239
Trypanosoma cruzi	cysteine proteinase, putative	0.1071	0.1648	0.1442
Entamoeba histolytica	cysteine proteinase, putative	0.1335	0.2465	0.2994
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.2453	0.5928	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.1952	0.4377	1
Echinococcus granulosus	cathepsin b	0.3767	1	1
Brugia malayi	Cathepsin L-like precursor	0.1335	0.2465	0.2279
Echinococcus granulosus	cathepsin l1	0.1335	0.2465	0.0978
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.3767	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.2453	0.5928	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1952	0.4377	1
Loa Loa (eye worm)	cysteine proteinase cathepsin Z	0.0697	0.0488	0.0253
Brugia malayi	Cathepsin L-like precursor	0.1952	0.4377	0.4239
Entamoeba histolytica	cysteine proteinase, putative	0.1952	0.4377	1
Echinococcus multilocularis	cathepsin b	0.3767	1	1
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.1952	0.4377	0.3268
Trypanosoma cruzi	cysteine peptidase, putative	0.2453	0.5928	0.5827
Plasmodium vivax	vivapain-2	0.1952	0.4377	1
Plasmodium vivax	vivapain-3	0.1071	0.1648	0.3765
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0697	0.0488	0.0253
Onchocerca volvulus		0.1952	0.4377	1
Onchocerca volvulus		0.1952	0.4377	1
Trypanosoma cruzi	major cysteine proteinase, putative	0.0955	0.1286	0.1071
Trypanosoma cruzi	cysteine peptidase, putative	0.1952	0.4377	0.4239
Loa Loa (eye worm)	cysteine protease	0.1952	0.4377	0.4239
Leishmania major	cathepsin L-like protease	0.2453	0.5928	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.2453	0.5928	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.2453	0.5928	1
Brugia malayi	Cathepsin L-like precursor	0.1335	0.2465	0.2279
Onchocerca volvulus	Cathepsin F homolog	0.1952	0.4377	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1952	0.4377	1
Plasmodium falciparum	dipeptidyl aminopeptidase 2	0.0679	0.0432	0.0986
Brugia malayi	Papain family cysteine protease containing protein	0.1071	0.1648	0.1442
Trypanosoma cruzi	cysteine peptidase, putative	0.2453	0.5928	0.5827
Schistosoma mansoni	dipeptidyl-peptidase I (C01 family)	0.0679	0.0432	0.0195
Toxoplasma gondii	cathepsin CPL	0.1952	0.4377	1
Schistosoma mansoni	cathepsin F (C01 family)	0.1335	0.2465	0.2279
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.2453	0.5928	1
Giardia lamblia	Cathepsin B precursor	0.1479	0.291	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.3767	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1952	0.4377	1
Echinococcus multilocularis	cysteine protease	0.1952	0.4377	0.3268
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1952	0.4377	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1952	0.4377	1
Leishmania major	cathepsin L-like protease	0.1952	0.4377	0.4862
Onchocerca volvulus		0.1952	0.4377	1
Entamoeba histolytica	cysteine proteinase, putative	0.1952	0.4377	1
Brugia malayi	Cathepsin L-like precursor	0.1952	0.4377	0.4239
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1952	0.4377	1
Leishmania major	cathepsin L-like protease	0.1952	0.4377	0.4862
Echinococcus granulosus	cathepsin l cysteine peptidase	0.1952	0.4377	0.3268
Loa Loa (eye worm)	fibroinase	0.1952	0.4377	0.4239
Echinococcus multilocularis	cathepsin b	0.3767	1	1
Entamoeba histolytica	cysteine protease, putative	0.1952	0.4377	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.3767	1	1
Brugia malayi	Cathepsin L-like precursor	0.1952	0.4377	0.4239
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1952	0.4377	1
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.3767	1	1
Leishmania major	cathepsin L-like protease	0.1952	0.4377	0.4862
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1952	0.4377	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1335	0.2465	0.5458
Plasmodium falciparum	dipeptidyl aminopeptidase 1	0.0679	0.0432	0.0986
Plasmodium vivax	dipeptidyl aminopeptidase 2, putative	0.0679	0.0432	0.0986
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0697	0.0488	0.0253
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0697	0.0488	0.0761
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.1071	0.1648	0.1442
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1952	0.4377	1
Onchocerca volvulus		0.1952	0.4377	1
Loa Loa (eye worm)	hypothetical protein	0.1335	0.2465	0.2279
Schistosoma mansoni	cathepsin F (C01 family)	0.1952	0.4377	0.4239
Onchocerca volvulus	Cathepsin L homolog	0.1952	0.4377	1
Brugia malayi	Cathepsin L-like precursor	0.1952	0.4377	0.4239
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.1479	0.291	0.2736
Leishmania major	cathepsin L-like protease	0.1952	0.4377	0.4862
Onchocerca volvulus	Cathepsin L homolog	0.1952	0.4377	1
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.1071	0.1648	0.1442
Brugia malayi	Papain family cysteine protease containing protein	0.1071	0.1648	0.1442
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1952	0.4377	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.1952	0.4377	0.4239
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1952	0.4377	1
Echinococcus multilocularis	cathepsin L cysteine protease	0.1952	0.4377	0.3268
Toxoplasma gondii	preprocathepsin c precursor, putative	0.0679	0.0432	0.0986
Schistosoma mansoni	cathepsin F (C01 family)	0.1952	0.4377	0.4239
Brugia malayi	Cathepsin L-like precursor	0.1952	0.4377	0.4239

Activities

Activity type	Activity value	Assay description	Source	Reference
Activity (functional)	x 0	Activity of the compound at 10 ppm against Lactobacillus plantarum; x=Effective	ChEMBL.	6644743
Activity (functional)	x 0	Activity of the compound at 10 ppm against Streptococcus faecalis; x=Effective	ChEMBL.	6644743
Activity (functional)	0	Bacteriostatic activity of the compound against Staphylococcus aureus ATCC 6538 at 10 ppm concentration; + =Positive	ChEMBL.	6644743
Activity (functional)	0	Bactericidal activity of the compound against Staphylococcus aureus ATCC 6538 at 10 ppm concentration; - = Negative	ChEMBL.	6644743
MIC (functional)	= 1 p.p.m.	Minimum inhibitory concentration against staphylococcus aureus ATCC 6538	ChEMBL.	6644743

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

ChEMBL: CHEMBL49168
PubChem: 8523365

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 72241