TDR Targets

Basic information

Technical information

TDR Targets ID: 795675
Name: 5-chloro-3-[2-[(3-chlorophenyl)-ethylamino]-2 -oxoethyl]-1H-indole-2-carboxylic acid
MW: 391.248 | Formula: C19H16Cl2N2O3
H donors: 2 H acceptors: 3 LogP: 4.31 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: CCN(C(=O)Cc1c([nH]c2c1cc(Cl)cc2)C(=O)O)c1cccc(c1)Cl
InChi: 1S/C19H16Cl2N2O3/c1-2-23(13-5-3-4-11(20)8-13)17(24)10-15-14-9-12(21)6-7-16(14)22-18(15)19(25)26/h3-9,22H,2,10H2,1H3,(H,25,26)
InChiKey: WBMDPGHERCVDDJ-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-chloro-3-[2-[(3-chlorophenyl)-ethyl-amino]-2-oxo-ethyl]-1H-indole-2-carboxylic acid
5-chloro-3-[2-[(3-chlorophenyl)-ethyl-amino]-2-keto-ethyl]-1H-indole-2-carboxylic acid
EU-0058526

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	glutaminase, putative	0.0311	1	1
Onchocerca volvulus	Huntingtin homolog	0.014	0.3729	0.498
Brugia malayi	Pre-SET motif family protein	0.0213	0.6413	0.6413
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0499	0.0499
Schistosoma mansoni	tar DNA-binding protein	0.0137	0.3636	0.3636
Loa Loa (eye worm)	glutamate receptor	0.0091	0.1943	0.1943
Giardia lamblia	Fructose-bisphosphate aldolase	0.0299	0.9558	0.5
Loa Loa (eye worm)	TAR-binding protein	0.0137	0.3636	0.3636
Onchocerca volvulus	Huntingtin homolog	0.014	0.3729	0.498
Schistosoma mansoni	tar DNA-binding protein	0.0137	0.3636	0.3636
Mycobacterium leprae	Probable fructose bisphosphate aldolase Fba	0.0146	0.3971	0.5
Brugia malayi	RNA recognition motif domain containing protein	0.0137	0.3636	0.3636
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0052	0.0537	0.0598
Brugia malayi	glutaminase DH11.1	0.0311	1	1
Mycobacterium ulcerans	glutaminase	0.0311	1	1
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0299	0.9558	0.824
Schistosoma mansoni	metabotropic glutamate receptor	0.0193	0.5677	0.5677
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0052	0.0537	0.0537
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0051	0.0499	0.0499
Brugia malayi	metabotropic glutamate receptor subtype 5a (mGluR5a), putative	0.0209	0.6251	0.6251
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0299	0.9558	0.824
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0052	0.0537	0.0598
Brugia malayi	TAR-binding protein	0.0137	0.3636	0.3636
Treponema pallidum	fructose-bisphosphate aldolase	0.0299	0.9558	0.5
Mycobacterium tuberculosis	Probable fructose-bisphosphate aldolase Fba	0.0146	0.3971	0.5
Brugia malayi	Receptor family ligand binding region containing protein	0.0059	0.079	0.079
Loa Loa (eye worm)	hypothetical protein	0.0284	0.8984	0.8984
Echinococcus granulosus	metabotropic glutamate receptor 2	0.0193	0.5677	0.6319
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0052	0.0537	0.0598
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0299	0.9558	0.824
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0051	0.0499	0.0499
Echinococcus multilocularis	tar DNA binding protein	0.0137	0.3636	0.4047
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0299	0.9558	0.824
Loa Loa (eye worm)	hypothetical protein	0.014	0.3729	0.3729
Schistosoma mansoni	metabotropic glutamate receptor 2 3 (mglur group 2)	0.0262	0.8194	0.8194
Echinococcus multilocularis	metabotropic glutamate receptor 5	0.0284	0.8984	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0052	0.0537	0.0537
Loa Loa (eye worm)	glutamate receptor	0.023	0.7042	0.7042
Echinococcus granulosus	tar DNA binding protein	0.0137	0.3636	0.4047
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0299	0.9558	0.824
Loa Loa (eye worm)	RNA binding protein	0.0137	0.3636	0.3636
Schistosoma mansoni	tar DNA-binding protein	0.0137	0.3636	0.3636
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0299	0.9558	0.824
Schistosoma mansoni	tar DNA-binding protein	0.0137	0.3636	0.3636
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0052	0.0537	0.0537
Schistosoma mansoni	tar DNA-binding protein	0.0137	0.3636	0.3636
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0299	0.9558	0.824
Echinococcus granulosus	metabotropic glutamate receptor 5	0.0284	0.8984	1
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0213	0.6413	0.6413
Brugia malayi	Metabotropic glutamate receptor precursor.	0.023	0.7042	0.7042
Loa Loa (eye worm)	glutaminase	0.0311	1	1
Brugia malayi	hypothetical protein	0.014	0.3729	0.3729
Loa Loa (eye worm)	hypothetical protein	0.014	0.3729	0.3729
Schistosoma mansoni	metabotropic glutamate receptor	0.0112	0.2733	0.2733
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0052	0.0537	0.0537
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0137	0.3636	0.3636
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0299	0.9558	0.824
Echinococcus multilocularis	metabotropic glutamate receptor 2	0.0193	0.5677	0.6319
Loa Loa (eye worm)	metabotropic GABA-B receptor subtype 2	0.0059	0.079	0.079
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0052	0.0537	0.0598
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0299	0.9558	0.5
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0051	0.0499	0.0499
Brugia malayi	metabotropic glutamate receptor type 2	0.0112	0.2733	0.2733
Onchocerca volvulus		0.0243	0.7488	1
Brugia malayi	RNA binding protein	0.0137	0.3636	0.3636
Loa Loa (eye worm)	hypothetical protein	0.0059	0.079	0.079
Loa Loa (eye worm)	receptor family ligand binding region containing protein	0.0059	0.079	0.079
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0299	0.9558	0.5
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0052	0.0537	0.0537
Schistosoma mansoni	glutaminase	0.0311	1	1

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 795675