TDR Targets

Basic information

Technical information

TDR Targets ID: 1659006
Name: 8-[3-(5-pyridin-3-ylfuran-2-yl)-1,2,4-oxadiaz ol-5-yl]-1-azabicyclo[2.2.2]octane
MW: 322.361 | Formula: C18H18N4O2
H donors: 0 H acceptors: 3 LogP: 2.14 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: c1ccc(cn1)c1ccc(o1)c1noc(n1)C1CN2CCC1CC2
InChi: 1S/C18H18N4O2/c1-2-13(10-19-7-1)15-3-4-16(23-15)17-20-18(24-21-17)14-11-22-8-5-12(14)6-9-22/h1-4,7,10,12,14H,5-6,8-9,11H2
InChiKey: HAFBPVOPBRQKOM-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

3-[3-[5-(3-pyridyl)-2-furyl]-1,2,4-oxadiazol-5-yl]quinuclidine

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	potassium voltage-gated channel, subfamily H (eag-related), member 2	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Echinococcus granulosus	potassium voltage gated channel subfamily H	Get druggable targets OG5_128858	All targets in OG5_128858
Loa Loa (eye worm)	voltage and ligand gated potassium channel	Get druggable targets OG5_128858	All targets in OG5_128858
Schistosoma japonicum	ko:K04910 potassium voltage-gated channel, Eag-related subfamily H, member 7, putative	Get druggable targets OG5_128858	All targets in OG5_128858
Schistosoma japonicum	Potassium voltage-gated channel subfamily H member 2, putative	Get druggable targets OG5_128858	All targets in OG5_128858
Schistosoma japonicum	ko:K04910 potassium voltage-gated channel, Eag-related subfamily H, member 7, putative	Get druggable targets OG5_128858	All targets in OG5_128858
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128858	All targets in OG5_128858
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	Get druggable targets OG5_128858	All targets in OG5_128858
Schistosoma mansoni	voltage-gated potassium channel	Get druggable targets OG5_128858	All targets in OG5_128858
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	Get druggable targets OG5_128858	All targets in OG5_128858
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	Get druggable targets OG5_128858	All targets in OG5_128858
Schistosoma mansoni	voltage-gated potassium channel	Get druggable targets OG5_128858	All targets in OG5_128858
Echinococcus multilocularis	potassium voltage gated channel subfamily H	Get druggable targets OG5_128858	All targets in OG5_128858

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
Echinococcus multilocularis	ATP dependent DNA helicase Q5	0.002	0.0394	0.3166
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0009	0.0054	0.043
Brugia malayi	Protein kinase domain containing protein	0.012	0.3392	0.3356
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0045	0.1127	1
Schistosoma mansoni	voltage-gated potassium channel	0.0013	0.0177	0.1414
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.0045	0.1127	0.1079
Schistosoma mansoni	blooms syndrome DNA helicase	0.001	0.0097	0.0777
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.003	0.0699	0.6017
Trichomonas vaginalis	DNA helicase recq, putative	0.002	0.0394	0.0488
Brugia malayi	Pre-SET motif family protein	0.0211	0.6136	0.6115
Brugia malayi	Fibroblast growth factor family protein	0.034	1	1
Plasmodium falciparum	ADP-dependent DNA helicase RecQ	0.002	0.0394	1
Loa Loa (eye worm)	hypothetical protein	0.034	1	1
Plasmodium falciparum	ATP-dependent DNA helicase Q1	0.002	0.0394	1
Schistosoma mansoni	hyperpolarization activated cyclic nucleotide-gated potassium channel	0.0009	0.0054	0.043
Echinococcus granulosus	ATP dependent DNA helicase Q5	0.002	0.0394	0.3166
Echinococcus granulosus	bloom syndrome protein	0.002	0.0394	0.3166
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.003	0.0699	0.5597
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0019	0.0363	1
Giardia lamblia	Hypothetical protein	0.034	1	1
Schistosoma mansoni	lamin	0.0027	0.0589	0.4715
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.003	0.0699	0.5597
Schistosoma mansoni	ap endonuclease	0.0019	0.0363	0.2902
Toxoplasma gondii	exonuclease III APE	0.0019	0.0363	0.4514
Echinococcus multilocularis	lamin dm0	0.0027	0.0589	0.4991
Loa Loa (eye worm)	hypothetical protein	0.001	0.0097	0.0044
Brugia malayi	cytoplasmic intermediate filament protein	0.0014	0.0218	0.0165
Onchocerca volvulus		0.0241	0.7013	1
Echinococcus granulosus	lamin	0.0027	0.0589	0.4991
Schistosoma mansoni	intermediate filament proteins	0.0027	0.0589	0.4715
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0019	0.0363	0.2878
Loa Loa (eye worm)	hypothetical protein	0.0013	0.0175	0.0122
Loa Loa (eye worm)	intermediate filament protein	0.0027	0.0589	0.0538
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.002	0.0394	0.5017
Loa Loa (eye worm)	hypothetical protein	0.012	0.3392	0.3356
Brugia malayi	Pre-SET motif family protein	0.003	0.0699	0.0649
Trichomonas vaginalis	ap endonuclease, putative	0.0019	0.0363	0.0444
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0042	0.1039	0.1415
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0161	0.0107
Loa Loa (eye worm)	cytoplasmic intermediate filament protein	0.0014	0.0218	0.0165
Entamoeba histolytica	exodeoxyribonuclease III, putative	0.0019	0.0363	0.8998
Trypanosoma brucei	ATP-dependent DEAD/H DNA helicase recQ, putative	0.002	0.0394	1
Loa Loa (eye worm)	hypothetical protein	0.003	0.0699	0.0649
Brugia malayi	Intermediate filament tail domain containing protein	0.0027	0.0589	0.0538
Echinococcus multilocularis	bloom syndrome protein	0.002	0.0394	0.3166
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	0.0019	0.0363	0.5
Echinococcus granulosus	intermediate filament protein	0.0027	0.0589	0.4991
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0019	0.0363	0.2878
Plasmodium vivax	ADP-dependent DNA helicase RecQ, putative	0.001	0.0097	0.0191
Leishmania major	ATP-dependent DEAD/H DNA helicase recQ, putative	0.002	0.0394	1
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0009	0.0054	0.043
Loa Loa (eye worm)	ATP-dependent DNA helicase	0.002	0.0394	0.0342
Echinococcus multilocularis	ATP dependent DNA helicase Q1	0.002	0.0394	0.3166
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0042	0.1039	0.1415
Entamoeba histolytica	recQ family helicase, putative	0.002	0.0394	1
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0013	0.0177	0.1145
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0013	0.0177	0.1145
Onchocerca volvulus		0.003	0.0699	0.0172
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0211	0.6136	0.6115
Echinococcus multilocularis	cytoplasmic intermediate filament protein	0.0013	0.0175	0.1132
Giardia lamblia	Sgs1 DNA helicase, putative	0.002	0.0394	0.0032
Brugia malayi	ATP-dependent DNA helicase, RecQ family protein	0.002	0.0394	0.0342
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0045	0.1127	1
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.002	0.0394	0.5017
Echinococcus granulosus	ATP dependent DNA helicase Q1	0.002	0.0394	0.3166
Loa Loa (eye worm)	hypothetical protein	0.002	0.0394	0.0342
Brugia malayi	intermediate filament protein	0.0027	0.0589	0.0538
Echinococcus granulosus	voltage gated potassium channel	0.0013	0.0177	0.1145
Schistosoma mansoni	blooms syndrome DNA helicase	0.001	0.0085	0.0684
Trichomonas vaginalis	set domain proteins, putative	0.0241	0.7013	1
Schistosoma mansoni	ap endonuclease	0.0019	0.0363	0.2902
Trichomonas vaginalis	DNA helicase recq, putative	0.002	0.0394	0.0488
Loa Loa (eye worm)	hypothetical protein	0.034	1	1
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0027	0.0589	0.0538
Loa Loa (eye worm)	hypothetical protein	0.001	0.0097	0.0044
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0589	0.0538
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0019	0.0363	0.0311
Loa Loa (eye worm)	RecQ helicase	0.002	0.0394	0.0342
Schistosoma mansoni	DNA helicase recq1	0.002	0.0394	0.3149
Brugia malayi	exodeoxyribonuclease III family protein	0.0019	0.0363	0.0311
Echinococcus multilocularis	lamin	0.0027	0.0589	0.4991
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.003	0.0699	0.5597
Echinococcus granulosus	histone lysine methyltransferase setb	0.003	0.0699	0.6017
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.003	0.0699	0.5597
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0009	0.0054	0.043
Brugia malayi	Bloom's syndrome protein homolog	0.002	0.0394	0.0342
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0575	0.0524
Schistosoma mansoni	voltage-gated potassium channel	0.0049	0.125	1
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.003	0.0699	1
Schistosoma mansoni	DNA helicase recq5	0.002	0.0394	0.3149
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0161	0.0107
Schistosoma mansoni	lamin	0.0027	0.0589	0.4715
Loa Loa (eye worm)	hypothetical protein	0.0039	0.095	0.0901
Echinococcus multilocularis	musashi	0.0027	0.0589	0.4991
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0019	0.0363	0.4514
Echinococcus multilocularis	voltage gated potassium channel	0.0013	0.0177	0.1145
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.0019	0.0363	0.8958
Trichomonas vaginalis	DNA helicase recq1, putative	0.002	0.0394	0.0488
Entamoeba histolytica	recQ family DNA helicase	0.001	0.0097	0.0381
Schistosoma mansoni	hyperpolarization activated cyclic nucleotide-gated potassium channel	0.0009	0.0054	0.043
Plasmodium vivax	SET domain protein, putative	0.003	0.0699	1
Schistosoma mansoni	voltage-gated potassium channel	0.0009	0.0054	0.043
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.0019	0.0363	0.8958
Loa Loa (eye worm)	hypothetical protein	0.0013	0.0177	0.0124
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0019	0.0363	0.5
Trichomonas vaginalis	ap endonuclease, putative	0.0019	0.0363	0.0444
Schistosoma mansoni	voltage-gated potassium channel	0.0049	0.125	1
Echinococcus granulosus	cytoplasmic intermediate filament protein	0.0013	0.0175	0.1132
Brugia malayi	ATP-dependent DNA helicase, RecQ family protein	0.002	0.0394	0.0342
Echinococcus granulosus	lamin dm0	0.0027	0.0589	0.4991
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.001	0.0097	0.0191
Trypanosoma cruzi	ATP-dependent DEAD/H DNA helicase recQ, putative	0.002	0.0394	1
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	0.0019	0.0363	0.5
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0029	0.0666	0.5705
Schistosoma mansoni	voltage-gated potassium channel	0.0013	0.0177	0.1414
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.0045	0.1127	0.1079
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.003	0.0699	0.6017
Brugia malayi	Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog	0.0013	0.0177	0.0124

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 6.4 uM	Inhibition of human ERG channel expressed in CHO cells by patch clamp assay	ChEMBL.	22185670

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: CHEMBL2069928

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 1659006