TDR Targets

Basic information

Technical information

TDR Targets ID: 272914
Name: (5-chloroquinolin-8-yl) N-phenylcarbamate
MW: 298.724 | Formula: C16H11ClN2O2
H donors: 1 H acceptors: 2 LogP: 3.96 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: O=C(Oc1ccc(c2c1nccc2)Cl)Nc1ccccc1
InChi: 1S/C16H11ClN2O2/c17-13-8-9-14(15-12(13)7-4-10-18-15)21-16(20)19-11-5-2-1-3-6-11/h1-10H,(H,19,20)
InChiKey: KGYKIUCHGZYUHP-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-8-quinolyl) N-phenylcarbamate
N-phenylcarbamic acid (5-chloro-8-quinolyl) ester
Oprea1_375639
ST5073259

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)	hypothetical protein	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0049	0.2019	0.1777
Brugia malayi	hypothetical protein	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Brugia malayi	ORL1-like opioid receptor	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Loa Loa (eye worm)	melatonin receptor type 1A	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Loa Loa (eye worm)	intermediate filament protein	0.0029	0.0808	0.2187
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.002	0.0295	0.0798
Loa Loa (eye worm)	neuropeptide F receptor	0.002	0.0295	0.0798
Brugia malayi	hypothetical protein	0.002	0.0256	0.0694
Trypanosoma brucei	PAB1-binding protein , putative	0.003	0.0908	0.5
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0049	0.2019	0.5467
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Loa Loa (eye worm)	RNA binding protein	0.0076	0.3693	1
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.002	0.0295	0.0798
Echinococcus granulosus	tar DNA binding protein	0.0076	0.3693	0.3502
Brugia malayi	GnHR receptor homolog	0.002	0.0295	0.0798
Echinococcus multilocularis	lamin dm0	0.0029	0.0808	0.0529
Brugia malayi	hypothetical protein	0.002	0.0295	0.0798
Brugia malayi	RNA binding protein	0.0076	0.3693	1
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0776	0.2101
Brugia malayi	G protein-coupled receptor	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Toxoplasma gondii	LsmAD domain-containing protein	0.003	0.0908	0.5
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Brugia malayi	sulfakinin receptor protein	0.002	0.0295	0.0798
Plasmodium falciparum	ataxin-2 like protein, putative	0.003	0.0908	0.5
Echinococcus multilocularis	geminin	0.0181	1	1
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.002	0.0295	0.0798
Brugia malayi	Tachykinin-like peptides receptor 99D	0.002	0.0295	0.0798
Schistosoma mansoni	hypothetical protein	0.0181	1	1
Brugia malayi	Dopamine receptor	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Brugia malayi	G protein-coupled receptor F59B2.13	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Brugia malayi	hypothetical protein	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.002	0.0295	0.0798
Loa Loa (eye worm)	G-protein coupled receptor	0.002	0.0295	0.0798
Brugia malayi	Intermediate filament tail domain containing protein	0.0029	0.0808	0.2187
Loa Loa (eye worm)	TAR-binding protein	0.0076	0.3693	1
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.3693	0.3502
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.002	0.0295	0.0798
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0049	0.2019	0.1777
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Brugia malayi	Serotonin receptor	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0049	0.2019	0.5467
Plasmodium vivax	ataxin-2 like protein, putative	0.003	0.0908	0.5
Echinococcus granulosus	intermediate filament protein	0.0029	0.0808	0.0529
Brugia malayi	TAR-binding protein	0.0076	0.3693	1
Brugia malayi	G-protein coupled receptor	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0049	0.2019	0.1777
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Schistosoma mansoni	hypothetical protein	0.0181	1	1
Brugia malayi	putative neuropeptide receptor	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Brugia malayi	hypothetical protein	0.002	0.0295	0.0798
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0049	0.2019	0.1777
Brugia malayi	Dopamine receptor protein 1	0.002	0.0295	0.0798
Brugia malayi	Serotonin receptor	0.002	0.0295	0.0798
Brugia malayi	hypothetical protein	0.002	0.0295	0.0798
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.3693	0.3502
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.3693	0.3502
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0049	0.2019	0.1777
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Brugia malayi	hypothetical protein	0.003	0.0908	0.246
Loa Loa (eye worm)	TYRA-2 protein	0.002	0.0295	0.0798
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0029	0.0808	0.2187
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Onchocerca volvulus		0.0029	0.0808	1
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.3693	0.3502
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Brugia malayi	larval opioid receptor	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0808	0.2187
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Echinococcus multilocularis	musashi	0.0029	0.0808	0.0529
Leishmania major	hypothetical protein, conserved	0.003	0.0908	0.5
Brugia malayi	hypothetical protein	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Echinococcus multilocularis	lamin	0.0029	0.0808	0.0529
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Schistosoma mansoni	lamin	0.0029	0.0808	0.0529
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Loa Loa (eye worm)	G-protein coupled receptor	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Brugia malayi	hypothetical protein	0.002	0.0295	0.0798
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0049	0.2019	0.1777
Brugia malayi	neuropeptide F receptor	0.002	0.0295	0.0798
Brugia malayi	hypothetical protein	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Brugia malayi	hypothetical protein	0.002	0.0295	0.0798
Brugia malayi	intermediate filament protein	0.0029	0.0808	0.2187
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0076	0.3693	1
Brugia malayi	putative neuropeptide receptor NPR1	0.002	0.0295	0.0798
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.3693	0.3502
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Brugia malayi	G-protein coupled receptor	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.002	0.0295	0.0798
Echinococcus granulosus	lamin	0.0029	0.0808	0.0529
Brugia malayi	hypothetical protein	0.002	0.0295	0.0798
Brugia malayi	Melatonin receptor type 1A	0.002	0.0295	0.0798
Brugia malayi	follicle stimulating hormone receptor	0.002	0.0295	0.0798
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.002	0.0295	0.0798
Schistosoma mansoni	lamin	0.0029	0.0808	0.0529
Schistosoma mansoni	intermediate filament proteins	0.0029	0.0808	0.0529
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.002	0.0295	0.0798
Brugia malayi	AKH receptor	0.002	0.0295	0.0798
Brugia malayi	Dopamine receptor protein 2	0.002	0.0295	0.0798
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0049	0.2019	0.1777
Plasmodium falciparum	ataxin-2 like protein, putative	0.003	0.0908	0.5
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.002	0.0295	0.0798
Echinococcus multilocularis	tar DNA binding protein	0.0076	0.3693	0.3502
Brugia malayi	neuropeptide F receptor	0.002	0.0295	0.0798
Onchocerca volvulus		0.0029	0.0808	1
Brugia malayi	RNA recognition motif domain containing protein	0.0076	0.3693	1
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Echinococcus granulosus	lamin dm0	0.0029	0.0808	0.0529
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Loa Loa (eye worm)	hypothetical protein	0.002	0.0295	0.0798
Trypanosoma cruzi	PAB1-binding protein , putative	0.003	0.0908	0.5
Loa Loa (eye worm)	hypothetical protein	0.003	0.0908	0.246
Loa Loa (eye worm)	neuropeptide F receptor	0.002	0.0295	0.0798
Brugia malayi	RE15519p	0.002	0.0295	0.0798
Trypanosoma cruzi	PAB1-binding protein , putative	0.003	0.0908	0.5

Activities

Activity type	Activity value	Assay description	Source	Reference
Inhibition (functional)	= 4 %	Percent inhibition of adipocyte lipolysis in rat adipocyte assay was determined at 3 uM concentration.	ChEMBL.	3806604
Inhibition (functional)	= 69 %	Percentage inhibition of free fatty acid liberation at 100 microM determined in canine myocardial lipase assay	ChEMBL.	3806604

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: CHEMBL158536
PubChem: 853660

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 272914