TDR Targets

Basic information

Technical information

TDR Targets ID: 629695
Name: 8-[3-(4-bromo-2-chlorophenoxy)propoxy]quinoli ne
MW: 392.674 | Formula: C18H15BrClNO2
H donors: 0 H acceptors: 1 LogP: 5.5 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: Brc1ccc(c(c1)Cl)OCCCOc1cccc2c1nccc2
InChi: 1S/C18H15BrClNO2/c19-14-7-8-16(15(20)12-14)22-10-3-11-23-17-6-1-4-13-5-2-9-21-18(13)17/h1-2,4-9,12H,3,10-11H2
InChiKey: BMDPHICAGDIEPC-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

8-[3-(4-bromo-2-chloro-phenoxy)propoxy]quinoline
ZINC02985787

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
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0383	0.4021	0.4021
Echinococcus granulosus	mothers against decapentaplegic 6	0.0028	0.012	0.0199
Toxoplasma gondii	isocitrate dehydrogenase	0.0069	0.057	1
Leishmania major	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0069	0.057	1
Loa Loa (eye worm)	transcription factor SMAD2	0.0926	1	1
Brugia malayi	latrophilin 2 splice variant baaae	0.0262	0.2689	0.2689
Onchocerca volvulus	Mothers against decapentaplegic homolog	0.0028	0.012	0.5
Brugia malayi	Smad1	0.0063	0.0504	0.0504
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0121	0.1142	0.3706
Schistosoma mansoni	TGF-beta signal transducer Smad2	0.0063	0.0504	0.1516
Toxoplasma gondii	isocitrate dehydrogenase	0.0069	0.057	1
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0288	0.2976	0.2902
Echinococcus multilocularis	Smad4	0.0063	0.0504	0.1516
Schistosoma mansoni	smad	0.0063	0.0504	0.1516
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0069	0.057	0.1743
Plasmodium vivax	isocitrate dehydrogenase [NADP], mitochondrial, putative	0.0069	0.057	1
Brugia malayi	MH2 domain containing protein	0.0028	0.012	0.012
Echinococcus granulosus	Smad4	0.0063	0.0504	0.1516
Echinococcus multilocularis	TGF beta signal transducer SmadC	0.0063	0.0504	0.1516
Echinococcus granulosus	smad	0.0063	0.0504	0.1516
Wolbachia endosymbiont of Brugia malayi	acetylornithine transaminase protein	0.0023	0.0062	0.5
Brugia malayi	RNA binding protein	0.0288	0.2976	0.2976
Mycobacterium tuberculosis	Adenosylmethionine-8-amino-7-oxononanoate aminotransferase BioA	0.0161	0.1586	1
Echinococcus multilocularis	GPCR, family 2	0.0121	0.1142	0.3706
Brugia malayi	MH2 domain containing protein	0.0063	0.0504	0.0504
Echinococcus granulosus	NADP dependent isocitrate dehydrogenase	0.0069	0.057	0.1743
Loa Loa (eye worm)	MH1 domain-containing protein	0.0028	0.012	0.0016
Trypanosoma brucei	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0069	0.057	1
Schistosoma mansoni	hypothetical protein	0.0121	0.1142	0.3706
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0121	0.1142	0.3706
Loa Loa (eye worm)	TAR-binding protein	0.0288	0.2976	0.2902
Echinococcus granulosus	tar DNA binding protein	0.0288	0.2976	1
Trichomonas vaginalis	acetylornithine aminotransferase, putative	0.0161	0.1586	0.5
Loa Loa (eye worm)	hypothetical protein	0.0383	0.4021	0.3958
Loa Loa (eye worm)	hypothetical protein	0.0262	0.2689	0.2611
Trypanosoma brucei	isocitrate dehydrogenase, putative	0.0069	0.057	1
Echinococcus multilocularis	isocitrate dehydrogenase	0.0069	0.057	0.1743
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0194	0.009
Loa Loa (eye worm)	RNA binding protein	0.0288	0.2976	0.2902
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0121	0.1142	0.1142
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0069	0.057	0.1743
Schistosoma mansoni	tar DNA-binding protein	0.0288	0.2976	1
Echinococcus multilocularis	isocitrate dehydrogenase 2 (NADP+)	0.0069	0.057	0.1743
Loa Loa (eye worm)	hypothetical protein	0.0028	0.012	0.0016
Echinococcus multilocularis	mothers against decapentaplegic 5	0.0063	0.0504	0.1516
Schistosoma mansoni	NADP-specific isocitrate dehydrogenase	0.0069	0.057	0.1743
Schistosoma mansoni	tar DNA-binding protein	0.0288	0.2976	1
Schistosoma mansoni	Smad4	0.0063	0.0504	0.1516
Echinococcus multilocularis	mothers against decapentaplegic 6	0.0028	0.012	0.0199
Trypanosoma cruzi	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0069	0.057	1
Schistosoma mansoni	hypothetical protein	0.0262	0.2689	0.9013
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0121	0.1142	0.3706
Plasmodium falciparum	ataxin-2 like protein, putative	0.0027	0.0104	0.0827
Schistosoma mansoni	smad1 5 8 and	0.0063	0.0504	0.1516
Echinococcus multilocularis	smad	0.0063	0.0504	0.1516
Plasmodium falciparum	ataxin-2 like protein, putative	0.0027	0.0104	0.0827
Schistosoma mansoni	tar DNA-binding protein	0.0288	0.2976	1
Brugia malayi	mothers against decapentaplegic homolog 3	0.0028	0.012	0.012
Echinococcus multilocularis	mothers against decapentaplegic 2	0.0028	0.012	0.0199
Loa Loa (eye worm)	Smad1	0.0063	0.0504	0.0404
Schistosoma mansoni	hypothetical protein	0.0121	0.1142	0.3706
Brugia malayi	MH1 domain containing protein	0.0063	0.0504	0.0504
Giardia lamblia	DNA repair protein RAD52	0.0369	0.3871	0.5
Echinococcus multilocularis	tar DNA binding protein	0.0288	0.2976	1
Brugia malayi	Isocitrate dehydrogenase	0.0069	0.057	0.057
Echinococcus granulosus	mothers against decapentaplegic 2	0.0028	0.012	0.0199
Plasmodium vivax	ataxin-2 like protein, putative	0.0027	0.0104	0.0827
Echinococcus granulosus	mothers against decapentaplegic 5	0.0063	0.0504	0.1516
Mycobacterium ulcerans	hypothetical protein	0.0161	0.1586	1
Schistosoma mansoni	tar DNA-binding protein	0.0288	0.2976	1
Schistosoma mansoni	smad1 5 8 and	0.0063	0.0504	0.1516
Brugia malayi	RNA recognition motif domain containing protein	0.0288	0.2976	0.2976
Brugia malayi	hypothetical protein	0.0027	0.0104	0.0104
Schistosoma mansoni	hypothetical protein	0.0121	0.1142	0.3706
Brugia malayi	isocitrate dehydrogenase	0.0069	0.057	0.057
Schistosoma mansoni	smad1 5 8 and	0.0063	0.0504	0.1516
Mycobacterium tuberculosis	Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP)	0.0069	0.057	0.3333
Echinococcus granulosus	GPCR family 2	0.0121	0.1142	0.3706
Brugia malayi	MH2 domain containing protein	0.0063	0.0504	0.0504
Entamoeba histolytica	DNA repair and recombination protein RAD52, putative	0.0369	0.3871	1
Schistosoma mansoni	smad	0.0028	0.012	0.0199
Mycobacterium tuberculosis	Probable aminotransferase	0.0161	0.1586	1
Echinococcus granulosus	TGF beta signal transducer SmadC	0.0063	0.0504	0.1516
Schistosoma mansoni	Smad4	0.0028	0.012	0.0199
Loa Loa (eye worm)	MH2 domain-containing protein	0.0063	0.0504	0.0404
Brugia malayi	TAR-binding protein	0.0288	0.2976	0.2976
Loa Loa (eye worm)	MH2 domain-containing protein	0.0926	1	1
Mycobacterium ulcerans	adenosylmethionine-8-amino-7-oxononanoate aminotransferase	0.0161	0.1586	1
Brugia malayi	MH1 domain containing protein	0.0063	0.0504	0.0504
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0121	0.1142	0.3706
Trypanosoma cruzi	isocitrate dehydrogenase, putative	0.0069	0.057	1
Loa Loa (eye worm)	hypothetical protein	0.0121	0.1142	0.1049
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0383	0.4021	0.4021
Brugia malayi	MH1 domain containing protein	0.0035	0.0194	0.0194
Loa Loa (eye worm)	nuclear factor I	0.0035	0.0194	0.009
Schistosoma mansoni	hypothetical protein	0.0121	0.1142	0.3706
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0069	0.057	0.1743
Chlamydia trachomatis	glutamate-1-semialdehyde-2,1-aminomutase	0.0023	0.0062	0.5
Brugia malayi	MH1 domain containing protein	0.0035	0.0194	0.0194
Schistosoma mansoni	Smad4	0.0028	0.012	0.0199
Brugia malayi	4-aminobutyrate aminotransferase, mitochondrial precursor	0.0023	0.0062	0.0062
Schistosoma mansoni	tar DNA-binding protein	0.0288	0.2976	1
Brugia malayi	Latrophilin receptor protein 2	0.0121	0.1142	0.1142
Loa Loa (eye worm)	MH2 domain-containing protein	0.0028	0.012	0.0016
Loa Loa (eye worm)	isocitrate dehydrogenase	0.0069	0.057	0.0471
Plasmodium falciparum	isocitrate dehydrogenase [NADP], mitochondrial	0.0069	0.057	1
Mycobacterium leprae	PROBABLE ADENOSYLMETHIONINE-8-AMINO-7-OXONONANOATE AMINOTRANSFERASE BIOA	0.0161	0.1586	1
Loa Loa (eye worm)	MH1 domain-containing protein	0.0063	0.0504	0.0404
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0121	0.1142	0.1049
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0383	0.4021	0.3958
Toxoplasma gondii	LsmAD domain-containing protein	0.0027	0.0104	0.0827

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.

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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 629695