TDR Targets

Basic information

Technical information

TDR Targets ID: 1583271
Name: 7-(pyridin-3-ylmethyl)-1-azabicyclo[2.2.2]oct ane
MW: 202.295 | Formula: C13H18N2
H donors: 0 H acceptors: 1 LogP: 2.09 Rotable bonds: 2
Rule of 5 violations (Lipinski): 1
SMILES: c1ccc(cn1)CC1CC2CCN1CC2
InChi: 1S/C13H18N2/c1-2-12(10-14-5-1)9-13-8-11-3-6-15(13)7-4-11/h1-2,5,10-11,13H,3-4,6-9H2
InChiKey: XOXNEDDHVCBSGK-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

2-(3-pyridylmethyl)quinuclidine

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	cholinergic receptor, nicotinic, alpha 7 (neuronal)	Starlite/ChEMBL	References
Homo sapiens	cholinergic receptor, nicotinic, alpha 4 (neuronal)	Starlite/ChEMBL	References
Homo sapiens	cholinergic receptor, nicotinic, beta 2 (neuronal)		References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Onchocerca volvulus		Get druggable targets OG5_130932	All targets in OG5_130932
Onchocerca volvulus		Get druggable targets OG5_130932	All targets in OG5_130932
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_130932	All targets in OG5_130932
Schistosoma japonicum	Neuronal acetylcholine receptor subunit alpha-7 precursor, putative	Get druggable targets OG5_130932	All targets in OG5_130932
Echinococcus multilocularis	nicotinic acetylcholine receptor a11 subunit	Get druggable targets OG5_128160	All targets in OG5_128160
Echinococcus granulosus	nicotinic acetylcholine receptor alpha subunit	Get druggable targets OG5_128160	All targets in OG5_128160
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_130932	All targets in OG5_130932
Schistosoma japonicum	IPR006201,Neurotransmitter-gated ion-channel;IPR006029,Neurotransmitter-gated ion-channel transmembrane region,domain-containing	Get druggable targets OG5_130932	All targets in OG5_130932
Onchocerca volvulus	Putative nachr subunit	Get druggable targets OG5_128160	All targets in OG5_128160
Brugia malayi	nicotinic acetylcholine receptor alpha subunit, putative	Get druggable targets OG5_128160	All targets in OG5_128160
Schistosoma mansoni	nAChR subunit (ShAR1-beta-like)	Get druggable targets OG5_130932	All targets in OG5_130932
Schistosoma japonicum	ko:K04809 cholinergic receptor, nicotinic, alpha 7, putative	Get druggable targets OG5_130932	All targets in OG5_130932
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_130932	All targets in OG5_130932
Schistosoma japonicum	Neuronal acetylcholine receptor subunit alpha-7 precursor, putative	Get druggable targets OG5_130932	All targets in OG5_130932
Echinococcus multilocularis	nicotinic acetylcholine receptor subunit alpha 8	Get druggable targets OG5_128160	All targets in OG5_128160
Schistosoma japonicum	Neuronal acetylcholine receptor subunit alpha-7 precursor, putative	Get druggable targets OG5_130932	All targets in OG5_130932
Schistosoma mansoni	nAChR subunit (ShAR1-alpha-like)	Get druggable targets OG5_130932	All targets in OG5_130932
Echinococcus granulosus	nicotinic acetylcholine receptor subunit alpha 8	Get druggable targets OG5_128160	All targets in OG5_128160
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128160	All targets in OG5_128160
Echinococcus multilocularis	nicotinic acetylcholine receptor alpha subunit	Get druggable targets OG5_128160	All targets in OG5_128160
Loa Loa (eye worm)	nicotinic acetylcholine receptor alpha subunit	Get druggable targets OG5_128160	All targets in OG5_128160
Echinococcus granulosus	nicotinic acetylcholine receptor a11 subunit	Get druggable targets OG5_128160	All targets in OG5_128160
Onchocerca volvulus		Get druggable targets OG5_130932	All targets in OG5_130932
Brugia malayi	Cation transporter family protein	Get druggable targets OG5_130932	All targets in OG5_130932

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Brugia malayi	acetylcholine receptor alpha subunit precursor, putative	cholinergic receptor, nicotinic, alpha 7 (neuronal)	502 aa	513 aa	33.9 %
Brugia malayi	Cation transporter family protein	cholinergic receptor, nicotinic, beta 2 (neuronal)	502 aa	482 aa	32.4 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Schistosoma mansoni	nAChR subunit (ShAR1-beta-like)	0.0131	0.135	0.4658
Schistosoma mansoni	topbp1	0.0021	0.006	0.0207
Brugia malayi	ATP dependent DNA ligase C terminal region family protein	0.0021	0.006	0.0207
Trichomonas vaginalis	conserved hypothetical protein	0.0021	0.006	0.9999
Brugia malayi	hypothetical protein	0.0021	0.0056	0.0193
Onchocerca volvulus		0.0027	0.0131	0.0577
Trypanosoma brucei	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0017	0.0009	0.0254
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0056	0.0162
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0343	0.1155
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0045	0.0343	0.1183
Loa Loa (eye worm)	hypothetical protein	0.002	0.005	0.0141
Echinococcus multilocularis	nicotinic acetylcholine receptor alpha subunit	0.0131	0.135	0.135
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0045	0.0343	0.1183
Leishmania major	hypothetical protein, conserved	0.0023	0.0086	0.2402
Schistosoma mansoni	tar DNA-binding protein	0.0262	0.2898	1
Schistosoma mansoni	nAChR subunit	0.0045	0.0343	0.1183
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0106	0.1058	0.8837
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0019	0.0037	0.0306
Chlamydia trachomatis	acylglycerophosphoethanolamine acyltransferase	0.002	0.005	0.8307
Loa Loa (eye worm)	TAR-binding protein	0.0262	0.2898	1
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.0176
Plasmodium falciparum	glutathione reductase	0.0046	0.0357	1
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0343	0.1155
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.0176
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.0176
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0045	0.0343	0.1183
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0097	0.0305
Leishmania major	trypanothione reductase	0.0046	0.0357	1
Entamoeba histolytica	hypothetical protein	0.0077	0.0722	1
Echinococcus multilocularis	nicotinic acetylcholine receptor subunit alpha 8	0.0131	0.135	0.135
Schistosoma mansoni	DNA ligase IV	0.0021	0.006	0.0207
Schistosoma mansoni	nAChR subunit (ShAR1-beta2-like)	0.0045	0.0343	0.1183
Trypanosoma cruzi	isocitrate dehydrogenase, putative	0.0017	0.0009	0.0254
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0045	0.0343	0.1183
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0056	0.0162
Echinococcus multilocularis	nAChR subunit	0.0045	0.0343	0.0343
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0343	0.1155
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0056	0.0162
Echinococcus multilocularis	neuronal acetylcholine receptor subunit alpha 4	0.0045	0.0343	0.0343
Brugia malayi	Neuronal acetylcholine receptor protein, alpha-2 chain precursor	0.0021	0.0056	0.0193
Brugia malayi	acetylcholine receptor alpha subunit precursor, putative	0.0045	0.0343	0.1183
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0343	0.1155
Brugia malayi	glutamate-gated chloride channel alpha3A subunit, putative	0.0021	0.0056	0.0193
Schistosoma mansoni	nAChR subunit	0.0045	0.0343	0.1183
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0056	0.0162
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0045	0.0343	0.0343
Onchocerca volvulus		0.0024	0.0097	0.0319
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0046	0.0357	0.2985
Echinococcus granulosus	thioredoxin glutathione reductase	0.0046	0.0357	0.1233
Brugia malayi	hypothetical protein	0.0021	0.0056	0.0193
Loa Loa (eye worm)	glutathione reductase	0.0046	0.0357	0.1205
Schistosoma mansoni	transcription factor LCR-F1	0.0077	0.0722	0.249
Loa Loa (eye worm)	ACC-1 protein	0.0045	0.0343	0.1155
Echinococcus granulosus	glycine receptor subunit beta	0.0045	0.0343	0.1183
Toxoplasma gondii	ATPase, AAA family protein	0.0021	0.006	0.1676
Trypanosoma cruzi	BRCA1 C Terminus (BRCT) domain containing protein, putative	0.0021	0.006	0.1676
Chlamydia trachomatis	DNA ligase	0.0021	0.006	1
Trichomonas vaginalis	replication factor C large subunit, putative	0.0021	0.006	1
Brugia malayi	hypothetical protein	0.0077	0.0722	0.249
Schistosoma mansoni	tar DNA-binding protein	0.0262	0.2898	1
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0027	0.0131	0.1092
Mycobacterium ulcerans	acyl-CoA synthetase	0.0027	0.0131	1
Brugia malayi	TAR-binding protein	0.0262	0.2898	1
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0343	0.1155
Echinococcus multilocularis	isocitrate dehydrogenase 2 (NADP+)	0.0017	0.0009	0.0009
Echinococcus multilocularis	nibrin	0.0021	0.006	0.006
Loa Loa (eye worm)	hypothetical protein	0.002	0.005	0.0141
Echinococcus granulosus	nAChR subunit	0.0024	0.0097	0.0336
Mycobacterium tuberculosis	Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP)	0.0017	0.0009	0.0076
Schistosoma mansoni	nicotinic acetylcholine receptor alpha	0.0024	0.0097	0.0336
Entamoeba histolytica	Activator 1 140 kDa subunit, putative	0.0021	0.006	0.0000052789
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0045	0.0343	0.1183
Echinococcus multilocularis	nicotinic acetylcholine receptor subunit type	0.0021	0.0056	0.0056
Leishmania major	4-coumarate:coa ligase-like protein	0.0027	0.0131	0.3657
Schistosoma mansoni	tar DNA-binding protein	0.0262	0.2898	1
Trypanosoma cruzi	PAB1-binding protein , putative	0.0023	0.0086	0.2402
Mycobacterium leprae	PROBABLE NADH DEHYDROGENASE NDH	0.0106	0.1058	0.8776
Loa Loa (eye worm)	RNA binding protein	0.0262	0.2898	1
Brugia malayi	Cation transporter family protein	0.0131	0.135	0.4658
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0056	0.0162
Trypanosoma cruzi	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0017	0.0009	0.0254
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0056	0.0162
Toxoplasma gondii	thioredoxin reductase	0.0046	0.0357	1
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0027	0.0131	0.107
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0045	0.0343	0.0343
Mycobacterium tuberculosis	Probable reductase	0.0106	0.1058	0.8837
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0027	0.0131	1
Echinococcus granulosus	gamma aminobutyric acid receptor subunit	0.0021	0.0056	0.0193
Onchocerca volvulus		0.0131	0.135	1
Echinococcus granulosus	Cys loop ligand gated ion channel subunit	0.0021	0.0056	0.0193
Brugia malayi	Thioredoxin reductase	0.0046	0.0357	0.1233
Loa Loa (eye worm)	glutamate-gated chloride channel alpha3A subunit	0.0045	0.0343	0.1155
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0343	0.1155
Loa Loa (eye worm)	hypothetical protein	0.002	0.005	0.0141
Trypanosoma cruzi	FHA domain containing protein, putative	0.0021	0.006	0.1676
Mycobacterium ulcerans	hypothetical protein	0.0027	0.0131	1
Trypanosoma brucei	PAB1-binding protein , putative	0.0023	0.0086	0.2402
Loa Loa (eye worm)	hypothetical protein	0.0131	0.135	0.4641
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0045	0.0343	0.1183
Schistosoma mansoni	nAChR subunit	0.0021	0.0056	0.0193
Leishmania major	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0017	0.0009	0.0254
Brugia malayi	AMP-binding enzyme family protein	0.0027	0.0131	0.0451
Brugia malayi	glutathione reductase	0.0046	0.0357	0.1233
Echinococcus multilocularis	replication factor c subunit 1	0.0021	0.006	0.006
Loa Loa (eye worm)	ACC-1 protein	0.0045	0.0343	0.1155
Brugia malayi	hypothetical protein	0.0021	0.0056	0.0193
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0021	0.0056	0.0193
Trichomonas vaginalis	conserved hypothetical protein	0.0021	0.006	0.9999
Loa Loa (eye worm)	acetylcholine receptor protein	0.0021	0.0056	0.0162
Brugia malayi	AMP-binding enzyme family protein	0.0027	0.0131	0.0451
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0024	0.0097	0.0336
Plasmodium falciparum	ataxin-2 like protein, putative	0.0023	0.0086	0.2402
Mycobacterium tuberculosis	Probable oxidoreductase	0.0118	0.1197	1
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0106	0.1058	0.8837
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0024	0.0097	0.0336
Leishmania major	4-coumarate:coa ligase-like protein	0.0027	0.0131	0.3657
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0017	0.0009	0.0009
Brugia malayi	hypothetical protein	0.0021	0.006	0.0207
Trichomonas vaginalis	RNA polymerase II ctd phosphatase, putative	0.0021	0.006	0.9999
Brugia malayi	Isocitrate dehydrogenase	0.0017	0.0009	0.0031
Brugia malayi	excitatory GABA receptor EXP-1A	0.0045	0.0343	0.1183
Toxoplasma gondii	poly(ADP-ribose) polymerase catalytic domain-containing protein	0.0021	0.006	0.1676
Entamoeba histolytica	hypothetical protein	0.0077	0.0722	1
Schistosoma mansoni	nAChR subunit	0.0045	0.0343	0.1183
Trypanosoma brucei	isocitrate dehydrogenase, putative	0.0017	0.0009	0.0254
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0045	0.0343	0.1183
Mycobacterium tuberculosis	Probable dehydrogenase	0.0106	0.1058	0.8837
Plasmodium vivax	replication factor C subunit 1, putative	0.0021	0.006	0.1676
Loa Loa (eye worm)	ligand-Gated ion Channel family member	0.0045	0.0343	0.1155
Loa Loa (eye worm)	LGC-31 protein	0.0045	0.0343	0.1155
Plasmodium vivax	isocitrate dehydrogenase [NADP], mitochondrial, putative	0.0017	0.0009	0.0254
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.002	0.005	0.0416
Schistosoma mansoni	acetylcholine receptor subunit beta	0.0021	0.0056	0.0193
Echinococcus granulosus	nAChR subunit	0.0045	0.0343	0.1183
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0019	0.0037	0.0306
Schistosoma mansoni	neurotransmitter gated ion channel	0.0021	0.0056	0.0193
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0017	0.0009	0.0009
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0131	0.0421
Brugia malayi	acetylcholine receptor, alpha-type subunit unc-38 precursor	0.0045	0.0343	0.1183
Toxoplasma gondii	LsmAD domain-containing protein	0.0023	0.0086	0.2402
Brugia malayi	Hypothetical glycine receptor like protein T20B12.9 in chromosome III	0.0045	0.0343	0.1183
Brugia malayi	DKFZp564C0469 protein	0.0021	0.006	0.0207
Echinococcus multilocularis	glycine receptor subunit beta	0.0045	0.0343	0.0343
Plasmodium vivax	thioredoxin reductase, putative	0.0046	0.0357	1
Echinococcus multilocularis	gamma aminobutyric acid receptor subunit	0.0021	0.0056	0.0056
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0131	0.0421
Brugia malayi	nicotinic acetylcholine receptor alpha subunit, putative	0.0131	0.135	0.4658
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.0176
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0056	0.0162
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0077	0.0722	0.249
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0056	0.0162
Schistosoma mansoni	hypothetical protein	0.0077	0.0722	0.249
Echinococcus multilocularis	Cys loop ligand gated ion channel subunit	0.0045	0.0343	0.0343
Trichomonas vaginalis	conserved hypothetical protein	0.0021	0.006	0.9999
Wolbachia endosymbiont of Brugia malayi	NAD-dependent DNA ligase, Lig	0.0021	0.006	1
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0343	0.1155
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0027	0.0131	0.1092
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.0176
Plasmodium vivax	glutathione reductase, putative	0.0046	0.0357	1
Schistosoma mansoni	tar DNA-binding protein	0.0262	0.2898	1
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0343	0.1155
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0097	0.0305
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0046	0.0357	0.0357
Trichomonas vaginalis	chromosome transmission fidelity factor, putative	0.0021	0.006	1
Echinococcus granulosus	tar DNA binding protein	0.0262	0.2898	1
Schistosoma mansoni	nAChR subunit (ShAR1-alpha-like)	0.0131	0.135	0.4658
Mycobacterium ulcerans	NAD-dependent DNA ligase LigA	0.0021	0.006	0.4582
Giardia lamblia	Replication factor C, subunit 1	0.0021	0.006	1
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0027	0.0131	1
Brugia malayi	AMP-binding enzyme family protein	0.0027	0.0131	0.0451
Entamoeba histolytica	hypothetical protein	0.0077	0.0722	1
Brugia malayi	hypothetical protein	0.0021	0.0056	0.0193
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0027	0.0131	0.107
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0045	0.0343	0.0343
Loa Loa (eye worm)	nicotinic acetylcholine receptor alpha subunit	0.0131	0.135	0.4641
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0343	0.1155
Echinococcus multilocularis	nAChR subunit	0.0024	0.0097	0.0097
Mycobacterium ulcerans	acyl-CoA synthetase	0.0027	0.0131	1
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0056	0.0162
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0056	0.0162
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0343	0.1155
Onchocerca volvulus		0.0024	0.0097	0.0319
Schistosoma mansoni	nAChR subunit	0.0045	0.0343	0.1183
Onchocerca volvulus		0.0045	0.0343	0.2216
Brugia malayi	hypothetical protein	0.0021	0.0056	0.0193
Treponema pallidum	DNA ligase (lig)	0.0021	0.006	1
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0027	0.0131	0.0623
Brugia malayi	Hypothetical glycine receptor like protein T20B12.9 in chromosome III	0.0024	0.0097	0.0336
Loa Loa (eye worm)	thioredoxin reductase	0.0046	0.0357	0.1205
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0106	0.1058	0.8837
Brugia malayi	acetylcholine receptor protein, alpha-like chain, putative	0.0045	0.0343	0.1183
Brugia malayi	hypothetical protein	0.0021	0.006	0.0207
Echinococcus multilocularis	Cys loop ligand gated ion channel subunit	0.0021	0.0056	0.0056
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0118	0.1197	1
Loa Loa (eye worm)	nicotinic acetylcholine receptor non-alpha subunit	0.0045	0.0343	0.1155
Plasmodium vivax	acyl-CoA synthetase, putative	0.002	0.005	0.1392
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0343	0.1155
Echinococcus granulosus	glycine receptor subunit beta	0.0045	0.0343	0.1183
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0027	0.0131	1
Plasmodium falciparum	replication factor C subunit 1, putative	0.0021	0.006	0.1676
Brugia malayi	hypothetical protein	0.0023	0.0086	0.0296
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0343	0.1155
Schistosoma mansoni	chromosome transmission fidelity factor	0.0021	0.006	0.0207
Trypanosoma cruzi	trypanothione reductase, putative	0.0046	0.0357	1
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0106	0.1058	0.8837
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0056	0.0162
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0343	0.1155
Schistosoma mansoni	NADP-specific isocitrate dehydrogenase	0.0017	0.0009	0.0031
Loa Loa (eye worm)	excitatory GABA receptor EXP-1A	0.0045	0.0343	0.1155
Schistosoma mansoni	topbp1	0.0021	0.006	0.0207
Brugia malayi	RNA recognition motif domain containing protein	0.0262	0.2898	1
Loa Loa (eye worm)	neuronal acetylcholine receptor protein	0.0021	0.0056	0.0162
Onchocerca volvulus		0.0131	0.135	1
Echinococcus multilocularis	nicotinic acetylcholine receptor beta 1 subunit	0.0045	0.0343	0.0343
Entamoeba histolytica	hypothetical protein	0.0077	0.0722	1
Toxoplasma gondii	isocitrate dehydrogenase	0.0017	0.0009	0.0254
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0056	0.0162
Schistosoma mansoni	acetylcholine receptor-related	0.0021	0.0056	0.0193
Schistosoma mansoni	nAChR subunit	0.0021	0.0056	0.0193
Echinococcus granulosus	nicotinic acetylcholine receptor subunit type	0.0045	0.0343	0.1183
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0056	0.0162
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0118	0.1197	1
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0045	0.0343	0.1183
Loa Loa (eye worm)	hypothetical protein	0.011	0.1104	0.3791
Trichomonas vaginalis	conserved hypothetical protein	0.0021	0.006	0.9999
Schistosoma mansoni	nAChR subunit	0.0045	0.0343	0.1183
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0343	0.1155
Trichomonas vaginalis	conserved hypothetical protein	0.0021	0.006	0.9999
Trypanosoma brucei	trypanothione reductase	0.0046	0.0357	1
Schistosoma mansoni	nAChR subunit	0.0045	0.0343	0.1183
Echinococcus multilocularis	acetylcholine receptor subunit beta 1	0.0045	0.0343	0.0343
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0056	0.0162
Onchocerca volvulus		0.0045	0.0343	0.2216
Brugia malayi	Cation transporter family protein	0.0045	0.0343	0.1183
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0019	0.0037	0.0306
Onchocerca volvulus	Putative nachr subunit	0.0131	0.135	1
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0097	0.0305
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0097	0.0305
Echinococcus granulosus	nibrin	0.0021	0.006	0.0207
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0097	0.0305
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0131	0.0421
Echinococcus granulosus	nicotinic acetylcholine receptor beta 1 subunit	0.0045	0.0343	0.1183
Brugia malayi	glutamate-gated chloride channel alpha3A subunit, putative	0.0024	0.0097	0.0336
Onchocerca volvulus		0.0045	0.0343	0.2216
Echinococcus multilocularis	tar DNA binding protein	0.0262	0.2898	0.2898
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0027	0.0131	1
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0045	0.0343	0.1183
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0097	0.0305
Mycobacterium ulcerans	acyl-CoA synthetase	0.0027	0.0131	1
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0021	0.0056	0.0193
Echinococcus granulosus	nicotinic acetylcholine receptor subunit alpha 8	0.0131	0.135	0.4658
Schistosoma mansoni	tar DNA-binding protein	0.0262	0.2898	1
Echinococcus multilocularis	nicotinic acetylcholine receptor a11 subunit	0.0131	0.135	0.135
Plasmodium falciparum	ataxin-2 like protein, putative	0.0023	0.0086	0.2402
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0045	0.0343	0.1183
Leishmania major	4-coumarate:coa ligase-like protein	0.0027	0.0131	0.3657
Echinococcus granulosus	NADP dependent isocitrate dehydrogenase	0.0017	0.0009	0.0031
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0097	0.0305
Echinococcus granulosus	nicotinic acetylcholine receptor a11 subunit	0.0131	0.135	0.4658
Plasmodium falciparum	isocitrate dehydrogenase [NADP], mitochondrial	0.0017	0.0009	0.0254
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0086	0.0266
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0077	0.0722	0.0722
Brugia malayi	Cation transporter family protein	0.0045	0.0343	0.1183
Plasmodium vivax	ataxin-2 like protein, putative	0.0023	0.0086	0.2402
Trypanosoma brucei	BRCA1 C Terminus (BRCT) domain containing protein, putative	0.0021	0.006	0.1676
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0045	0.0343	0.1183
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0262	0.2898	1
Echinococcus multilocularis	isocitrate dehydrogenase	0.0017	0.0009	0.0009
Echinococcus granulosus	Cys loop ligand gated ion channel subunit	0.0045	0.0343	0.1183
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0343	0.1155
Echinococcus granulosus	acetylcholine receptor subunit beta 1	0.0045	0.0343	0.1183
Echinococcus granulosus	replication factor c subunit 1	0.0021	0.006	0.0207
Trichomonas vaginalis	chromosome transmission fidelity factor, putative	0.0021	0.006	1
Entamoeba histolytica	acyl-coA synthetase, putative	0.0027	0.0131	0.107
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0027	0.0131	0.0623
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0045	0.0343	0.1183
Onchocerca volvulus		0.0131	0.135	1
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0343	0.1155
Loa Loa (eye worm)	acetylcholine receptor alpha subunit	0.0045	0.0343	0.1155
Loa Loa (eye worm)	hypothetical protein	0.0131	0.135	0.4641
Trypanosoma cruzi	PAB1-binding protein , putative	0.0023	0.0086	0.2402
Loa Loa (eye worm)	hypothetical protein	0.002	0.005	0.0141
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0056	0.0162
Schistosoma mansoni	neurotransmitter gated ion channel	0.0021	0.0056	0.0193
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.0176
Brugia malayi	gamma-aminobutyric-acid receptor beta subunit precursor	0.0045	0.0343	0.1183
Plasmodium falciparum	acyl-CoA synthetase	0.002	0.005	0.1392
Schistosoma mansoni	neurotransmitter gated ion channel	0.0024	0.0097	0.0336
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0017	0.0009	0.0009
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0045	0.0343	0.1183
Trypanosoma cruzi	hypothetical protein, conserved	0.0021	0.006	0.1676
Loa Loa (eye worm)	hypothetical protein	0.002	0.005	0.0141
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0045	0.0343	0.1183
Brugia malayi	nicotinic acetylcholine receptor beta-1 chain precursor	0.0045	0.0343	0.1183
Brugia malayi	RNA binding protein	0.0262	0.2898	1
Onchocerca volvulus		0.0021	0.006	0.003
Brugia malayi	Acetylcholine receptor protein, alpha-like chain 1 precursor	0.0021	0.0056	0.0193
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0021	0.0056	0.0193
Trypanosoma cruzi	hypothetical protein, conserved	0.0021	0.006	0.1676
Toxoplasma gondii	isocitrate dehydrogenase	0.0017	0.0009	0.0254
Loa Loa (eye worm)	hypothetical protein	0.0131	0.135	0.4641
Trichomonas vaginalis	RNA polymerase II ctd phosphatase, putative	0.0021	0.006	0.9999
Loa Loa (eye worm)	glutamate-gated chloride channel alpha3A subunit	0.0021	0.0056	0.0162
Brugia malayi	isocitrate dehydrogenase	0.0017	0.0009	0.0031
Brugia malayi	Pax transcription activation domain interacting protein	0.0021	0.006	0.0207
Echinococcus granulosus	nicotinic acetylcholine receptor alpha subunit	0.0131	0.135	0.4658
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0024	0.0097	0.0336
Entamoeba histolytica	hypothetical protein	0.0024	0.0097	0.0565
Echinococcus multilocularis	glycine receptor subunit beta	0.0045	0.0343	0.0343
Loa Loa (eye worm)	GABA receptor subunit	0.0024	0.0097	0.0305
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0118	0.1197	1
Brugia malayi	topoisomerase	0.0021	0.006	0.0207
Echinococcus granulosus	neuronal acetylcholine receptor subunit alpha 4	0.0045	0.0343	0.1183
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0019	0.0037	0.0306
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0097	0.0305
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0045	0.0343	0.1183
Schistosoma mansoni	nAChR subunit	0.0045	0.0343	0.1183
Plasmodium falciparum	thioredoxin reductase	0.0046	0.0357	1
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.002	0.005	0.3806

Activities

Activity type	Activity value	Assay description	Source	Reference
Ki (binding)	= 32 nM	Displacement of [3H]nicotine human alpha4beta2 nAChR in SH-EP1 cell membranes	ChEMBL.	23126648
Ki (binding)	= 979 nM	Displacement of [3H]epibatidine form human alpha7 nAchR expressed in HEK293 cells	ChEMBL.	23126648

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: CHEMBL1789658

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1583271