TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 284.783 | Formula: C17H17ClN2
H donors: 1 H acceptors: 1 LogP: 3.48 Rotable bonds: 2
Rule of 5 violations (Lipinski): 1
SMILES: Clc1ccc(cc1)c1cncc(c1)C1CC2NC1CC2
InChi: 1S/C17H17ClN2/c18-14-3-1-11(2-4-14)12-7-13(10-19-9-12)16-8-15-5-6-17(16)20-15/h1-4,7,9-10,15-17,20H,5-6,8H2
InChiKey: PBZKITRBPZIVFA-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

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Rattus norvegicus	Neuronal acetylcholine receptor; alpha4/beta2	Starlite/ChEMBL	References
Rattus norvegicus	Neuronal acetylcholine receptor protein alpha-7 subunit	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
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
Schistosoma japonicum	ko:K04809 cholinergic receptor, nicotinic, alpha 7, putative	Get druggable targets OG5_130932	All targets in OG5_130932
Onchocerca volvulus		Get druggable targets OG5_130932	All targets in OG5_130932
Onchocerca volvulus		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
Schistosoma japonicum	Neuronal acetylcholine receptor subunit alpha-7 precursor, 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
Brugia malayi	Cation transporter family protein	Get druggable targets OG5_130932	All targets in OG5_130932
Schistosoma mansoni	nAChR subunit (ShAR1-beta-like)	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
Onchocerca volvulus		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
Loa Loa (eye worm)	hypothetical 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	Neurotransmitter-gated ion-channel transmembrane region family protein	Neuronal acetylcholine receptor protein alpha-7 subunit	502 aa	519 aa	25.6 %
Brugia malayi	nicotinic acetylcholine receptor beta-1 chain precursor	Neuronal acetylcholine receptor protein alpha-7 subunit	502 aa	484 aa	34.3 %
Loa Loa (eye worm)	hypothetical protein	Neuronal acetylcholine receptor protein alpha-7 subunit	502 aa	491 aa	36.0 %
Echinococcus multilocularis	nicotinic acetylcholine receptor a11 subunit	Neuronal acetylcholine receptor protein alpha-7 subunit	502 aa	501 aa	32.1 %
Schistosoma mansoni	nAChR subunit (ShAR1-beta2-like)	Neuronal acetylcholine receptor protein alpha-7 subunit	502 aa	511 aa	27.2 %
Onchocerca volvulus	39S ribosomal protein L13, mitochondrial homolog	Neuronal acetylcholine receptor protein alpha-7 subunit	502 aa	475 aa	36.8 %
Onchocerca volvulus	Acetylcholine receptor subunit alpha-type des-2 homolog	Neuronal acetylcholine receptor protein alpha-7 subunit	502 aa	530 aa	29.6 %
Onchocerca volvulus		Neuronal acetylcholine receptor protein alpha-7 subunit	502 aa	552 aa	24.3 %
Brugia malayi	nicotinic acetylcholine receptor alpha subunit, putative	Neuronal acetylcholine receptor protein alpha-7 subunit	502 aa	511 aa	36.0 %
Echinococcus multilocularis	nAChR subunit	Neuronal acetylcholine receptor protein alpha-7 subunit	502 aa	488 aa	27.9 %
Schistosoma japonicum	Neuronal acetylcholine receptor subunit alpha-3 precursor, putative	Neuronal acetylcholine receptor protein alpha-7 subunit	502 aa	518 aa	24.9 %
Drosophila melanogaster	nicotinic Acetylcholine Receptor alpha2	Neuronal acetylcholine receptor protein alpha-7 subunit	502 aa	508 aa	38.6 %
Loa Loa (eye worm)	acetylcholine receptor alpha subunit	Neuronal acetylcholine receptor protein alpha-7 subunit	502 aa	507 aa	35.3 %
Onchocerca volvulus	Putative zinc finger protein	Neuronal acetylcholine receptor protein alpha-7 subunit	502 aa	515 aa	36.9 %
Loa Loa (eye worm)	nicotinic acetylcholine receptor alpha subunit	Neuronal acetylcholine receptor protein alpha-7 subunit	502 aa	510 aa	36.1 %
Onchocerca volvulus	Acetylcholine receptor subunit alpha-type homolog	Neuronal acetylcholine receptor protein alpha-7 subunit	502 aa	513 aa	35.5 %
Onchocerca volvulus		Neuronal acetylcholine receptor protein alpha-7 subunit	502 aa	496 aa	35.5 %
Schistosoma mansoni	nAChR subunit	Neuronal acetylcholine receptor protein alpha-7 subunit	502 aa	543 aa	27.8 %
Echinococcus granulosus	nicotinic acetylcholine receptor alpha subunit	Neuronal acetylcholine receptor protein alpha-7 subunit	502 aa	486 aa	32.9 %
Brugia malayi	acetylcholine receptor alpha subunit precursor, putative	Neuronal acetylcholine receptor protein alpha-7 subunit	502 aa	497 aa	35.0 %
Brugia malayi	acetylcholine receptor protein, alpha-like chain, putative	Neuronal acetylcholine receptor protein alpha-7 subunit	502 aa	527 aa	33.6 %
Echinococcus multilocularis	nicotinic acetylcholine receptor alpha subunit	Neuronal acetylcholine receptor protein alpha-7 subunit	502 aa	486 aa	33.1 %
Onchocerca volvulus		Neuronal acetylcholine receptor protein alpha-7 subunit	502 aa	482 aa	42.9 %
Onchocerca volvulus	Acetylcholine receptor subunit alpha-type homolog	Neuronal acetylcholine receptor protein alpha-7 subunit	502 aa	501 aa	36.5 %
Onchocerca volvulus	Acetylcholine receptor subunit alpha-type homolog	Neuronal acetylcholine receptor protein alpha-7 subunit	502 aa	513 aa	35.5 %
Echinococcus granulosus	nicotinic acetylcholine receptor a11 subunit	Neuronal acetylcholine receptor protein alpha-7 subunit	502 aa	485 aa	32.6 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.002	0.0059	0.0059
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0173	0.3133	0.3133
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0038	0.0409	0.0416
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0081	0.1286	0.1306
Loa Loa (eye worm)	nucleolar RNA-associated protein alpha	0.0505	0.985	0.985
Loa Loa (eye worm)	Smad1	0.0035	0.0355	0.0355
Plasmodium vivax	importin-beta 2, putative	0.0047	0.0605	0.5883
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0026	0.0184	0.0187
Echinococcus multilocularis	importin subunit beta 1	0.0047	0.0605	0.0614
Brugia malayi	Hypothetical glycine receptor like protein T20B12.9 in chromosome III	0.002	0.0059	0.0059
Loa Loa (eye worm)	GABA receptor subunit	0.002	0.0059	0.0059
Echinococcus multilocularis	peptidase Clp (S14 family)	0.0043	0.0518	0.0526
Brugia malayi	Probable ClpP-like protease	0.0066	0.0975	0.0975
Brugia malayi	latrophilin 2 splice variant baaae	0.0118	0.2031	0.2031
Brugia malayi	Cation transporter family protein	0.0038	0.0409	0.0409
Loa Loa (eye worm)	acetylcholine receptor alpha subunit	0.0038	0.0409	0.0409
Schistosoma mansoni	importin beta-1	0.0047	0.0605	0.0614
Echinococcus granulosus	nAChR subunit	0.002	0.0059	0.006
Plasmodium vivax	GTP-binding nuclear protein RAN/TC4, putative	0.0035	0.0353	0.3074
Echinococcus multilocularis	glycine receptor subunit beta	0.0038	0.0409	0.0416
Onchocerca volvulus		0.0123	0.2135	0.5484
Brugia malayi	glutamate-gated chloride channel alpha3A subunit, putative	0.002	0.0059	0.0059
Mycobacterium tuberculosis	Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP)	0.0043	0.0518	0.5
Schistosoma mansoni	smad1 5 8 and	0.0035	0.0355	0.036
Schistosoma mansoni	nAChR subunit (ShAR1-alpha-like)	0.0123	0.2135	0.2167
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0038	0.0409	0.0409
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.002	0.0059	0.0059
Toxoplasma gondii	ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein	0.0066	0.0975	1
Brugia malayi	nicotinic acetylcholine receptor beta-1 chain precursor	0.0038	0.0409	0.0409
Brugia malayi	excitatory GABA receptor EXP-1A	0.0038	0.0409	0.0409
Echinococcus multilocularis	nicotinic acetylcholine receptor a11 subunit	0.0038	0.0409	0.0416
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0055	0.0752	0.0763
Schistosoma mansoni	nAChR subunit	0.0038	0.0409	0.0416
Schistosoma mansoni	Smad4	0.0035	0.0355	0.036
Brugia malayi	Importin beta-1 subunit	0.0047	0.0605	0.0605
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0409	0.0409
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0026	0.0184	0.0187
Leishmania major	importin beta-1 subunit, putative	0.0038	0.0424	1
Brugia malayi	RNA binding protein	0.0219	0.4068	0.4068
Echinococcus granulosus	acetylcholine receptor subunit beta 1	0.0038	0.0409	0.0416
Echinococcus multilocularis	nAChR subunit	0.0038	0.0409	0.0416
Echinococcus multilocularis	smad	0.0035	0.0355	0.036
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0038	0.0409	0.0409
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0081	0.1286	0.1306
Schistosoma mansoni	nAChR subunit	0.0038	0.0409	0.0416
Loa Loa (eye worm)	hypothetical protein	0.0019	0.004	0.004
Plasmodium vivax	ATP-dependent Clp protease proteolytic subunit, putative	0.0066	0.0975	1
Echinococcus granulosus	geminin	0.0278	0.5265	0.5345
Echinococcus granulosus	tar DNA binding protein	0.0219	0.4068	0.413
Echinococcus granulosus	ATP dependent Clp protease proteolytic subunit	0.0066	0.0975	0.099
Entamoeba histolytica	Ran family GTPase	0.0035	0.0353	0.8042
Echinococcus granulosus	nicotinic acetylcholine receptor subunit alpha 8	0.0038	0.0409	0.0416
Schistosoma mansoni	hypothetical protein	0.0278	0.5265	0.5345
Schistosoma mansoni	hypothetical protein	0.0055	0.0752	0.0763
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0055	0.0752	0.0763
Brugia malayi	hypothetical protein	0.0021	0.0077	0.0077
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0038	0.0409	0.0416
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0081	0.1286	0.1306
Loa Loa (eye worm)	MH2 domain-containing protein	0.0035	0.0355	0.0355
Echinococcus multilocularis	neuronal acetylcholine receptor subunit alpha 4	0.0038	0.0409	0.0416
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0081	0.1286	0.1286
Echinococcus multilocularis	nAChR subunit	0.002	0.0059	0.006
Echinococcus multilocularis	mothers against decapentaplegic 5	0.0035	0.0355	0.036
Schistosoma mansoni	nAChR subunit (ShAR1-beta2-like)	0.0038	0.0409	0.0416
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0185	0.3377	0.3377
Loa Loa (eye worm)	excitatory GABA receptor EXP-1A	0.0038	0.0409	0.0409
Wolbachia endosymbiont of Brugia malayi	ATP-dependent Clp protease proteolytic subunit	0.0066	0.0975	0.5
Schistosoma mansoni	hypothetical protein	0.0055	0.0752	0.0763
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0409	0.0409
Loa Loa (eye worm)	hypothetical protein	0.002	0.0059	0.0059
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0038	0.0409	0.0409
Onchocerca volvulus	Putative nachr subunit	0.0038	0.0409	0.1052
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0038	0.0409	0.0409
Loa Loa (eye worm)	hypothetical protein	0.0123	0.2135	0.2135
Schistosoma mansoni	nicotinic acetylcholine receptor alpha	0.002	0.0059	0.006
Schistosoma mansoni	smad	0.0035	0.0355	0.036
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0038	0.0409	0.0416
Brugia malayi	Pre-SET motif family protein	0.0185	0.3377	0.3377
Loa Loa (eye worm)	hypothetical protein	0.002	0.0059	0.0059
Echinococcus granulosus	glycine receptor subunit beta	0.0038	0.0409	0.0416
Echinococcus multilocularis	TGF beta signal transducer SmadC	0.0035	0.0355	0.036
Loa Loa (eye worm)	transcription factor SMAD2	0.0513	1	1
Onchocerca volvulus		0.002	0.0059	0.0151
Echinococcus multilocularis	glycine receptor subunit beta	0.0038	0.0409	0.0416
Brugia malayi	Pre-SET motif family protein	0.0026	0.0184	0.0184
Schistosoma mansoni	tar DNA-binding protein	0.0219	0.4068	0.413
Toxoplasma gondii	hypothetical protein	0.0023	0.0106	0.0328
Echinococcus granulosus	nicotinic acetylcholine receptor subunit type	0.0038	0.0409	0.0416
Onchocerca volvulus		0.0038	0.0409	0.1052
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0409	0.0409
Loa Loa (eye worm)	ACC-1 protein	0.0038	0.0409	0.0409
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0077	0.0077
Echinococcus granulosus	Smad4	0.0035	0.0355	0.036
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0026	0.0184	0.0187
Entamoeba histolytica	hypothetical protein	0.0038	0.0424	1
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0038	0.0409	0.0416
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0173	0.3133	0.3133
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0409	0.0409
Brugia malayi	Smad1	0.0035	0.0355	0.0355
Schistosoma mansoni	tar DNA-binding protein	0.0219	0.4068	0.413
Loa Loa (eye worm)	hypothetical protein	0.002	0.0059	0.0059
Loa Loa (eye worm)	ACC-1 protein	0.0038	0.0409	0.0409
Schistosoma mansoni	nAChR subunit	0.0038	0.0409	0.0416
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0038	0.0424	0.0202
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0605	0.0605
Echinococcus granulosus	peptidase Clp S14 family	0.0043	0.0518	0.0526
Echinococcus multilocularis	tar DNA binding protein	0.0219	0.4068	0.413
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0038	0.0409	0.0416
Trypanosoma cruzi	GTP-binding nuclear protein rtb2, putative	0.0035	0.0353	0.7942
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0409	0.0409
Loa Loa (eye worm)	MH1 domain-containing protein	0.0035	0.0355	0.0355
Schistosoma mansoni	hypothetical protein	0.0505	0.985	1
Schistosoma mansoni	hypothetical protein	0.0055	0.0752	0.0763
Brugia malayi	MH2 domain containing protein	0.0035	0.0355	0.0355
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0081	0.1286	0.1306
Schistosoma mansoni	ran	0.0035	0.0353	0.0358
Brugia malayi	TAR-binding protein	0.0219	0.4068	0.4068
Echinococcus granulosus	nicotinic acetylcholine receptor alpha subunit	0.0038	0.0409	0.0416
Trypanosoma brucei	GTP-binding nuclear protein rtb2, putative	0.0035	0.0353	0.5225
Echinococcus granulosus	GPCR family 2	0.0055	0.0752	0.0763
Brugia malayi	acetylcholine receptor, alpha-type subunit unc-38 precursor	0.0038	0.0409	0.0409
Schistosoma mansoni	tar DNA-binding protein	0.0219	0.4068	0.413
Loa Loa (eye worm)	hypothetical protein	0.0173	0.3133	0.3133
Mycobacterium tuberculosis	Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2)	0.0043	0.0518	0.5
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0038	0.0409	0.0416
Echinococcus granulosus	neuronal acetylcholine receptor subunit alpha 4	0.0038	0.0409	0.0416
Echinococcus multilocularis	ATP dependent Clp protease proteolytic subunit	0.0066	0.0975	0.099
Echinococcus granulosus	snurportin 1	0.0505	0.985	1
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0038	0.0409	0.0416
Echinococcus granulosus	nicotinic acetylcholine receptor a11 subunit	0.0038	0.0409	0.0416
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0038	0.0409	0.0416
Brugia malayi	nicotinic acetylcholine receptor alpha subunit, putative	0.0038	0.0409	0.0409
Trypanosoma cruzi	importin beta-1 subunit, putative	0.0038	0.0424	1
Echinococcus granulosus	nAChR subunit	0.0038	0.0409	0.0416
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0409	0.0409
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0055	0.0752	0.0752
Brugia malayi	MH1 domain containing protein	0.0019	0.004	0.004
Toxoplasma gondii	ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein	0.0066	0.0975	1
Brugia malayi	Latrophilin receptor protein 2	0.0055	0.0752	0.0752
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0173	0.3133	0.3133
Echinococcus multilocularis	acetylcholine receptor subunit beta 1	0.0038	0.0409	0.0416
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0409	0.0409
Loa Loa (eye worm)	hypothetical protein	0.0123	0.2135	0.2135
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0409	0.0409
Onchocerca volvulus		0.0123	0.2135	0.5484
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0026	0.0184	0.0187
Trichomonas vaginalis	importin beta-1, putative	0.0038	0.0424	0.0202
Giardia lamblia	GTP-binding nuclear protein RAN/TC4	0.0035	0.0353	0.5
Loa Loa (eye worm)	hypothetical protein	0.0055	0.0752	0.0752
Echinococcus granulosus	nicotinic acetylcholine receptor beta 1 subunit	0.0038	0.0409	0.0416
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0038	0.0409	0.0409
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0409	0.0409
Schistosoma mansoni	hypothetical protein	0.0278	0.5265	0.5345
Echinococcus granulosus	importin subunit beta 1	0.0047	0.0605	0.0614
Schistosoma mansoni	nAChR subunit	0.0038	0.0409	0.0416
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0038	0.0409	0.0409
Leishmania major	GTP-binding protein, putative	0.0035	0.0353	0.7942
Loa Loa (eye worm)	hypothetical protein	0.002	0.0059	0.0059
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0081	0.1286	0.1306
Echinococcus multilocularis	geminin	0.0278	0.5265	0.5345
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0055	0.0752	0.0763
Mycobacterium leprae	PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP)	0.0043	0.0518	0.4744
Schistosoma mansoni	TGF-beta signal transducer Smad2	0.0035	0.0355	0.036
Loa Loa (eye worm)	hypothetical protein	0.0106	0.1784	0.1784
Plasmodium falciparum	ATP-dependent Clp protease proteolytic subunit	0.0066	0.0975	1
Plasmodium vivax	ATP-dependent Clp protease proteolytic subunit, putative	0.0023	0.0106	0.0328
Brugia malayi	MH2 domain containing protein	0.0035	0.0355	0.0355
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0081	0.1286	0.1306
Brugia malayi	Hypothetical glycine receptor like protein T20B12.9 in chromosome III	0.0038	0.0409	0.0409
Schistosoma mansoni	peptidase Clp (S14 family)	0.0066	0.0975	0.099
Loa Loa (eye worm)	nicotinic acetylcholine receptor alpha subunit	0.0038	0.0409	0.0409
Schistosoma mansoni	hypothetical protein	0.0055	0.0752	0.0763
Onchocerca volvulus		0.0038	0.0409	0.1052
Onchocerca volvulus		0.002	0.0059	0.0151
Trypanosoma brucei	importin beta-1 subunit, putative	0.0047	0.0605	1
Echinococcus multilocularis	nicotinic acetylcholine receptor beta 1 subunit	0.0038	0.0409	0.0416
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0409	0.0409
Schistosoma mansoni	smad1 5 8 and	0.0035	0.0355	0.036
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0409	0.0409
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0409	0.0409
Schistosoma mansoni	smad1 5 8 and	0.0035	0.0355	0.036
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0184	0.0184
Schistosoma mansoni	tar DNA-binding protein	0.0219	0.4068	0.413
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0055	0.0752	0.0763
Mycobacterium ulcerans	ATP-dependent Clp protease proteolytic subunit	0.0066	0.0975	0.5
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0081	0.1286	0.1286
Trypanosoma cruzi	GTP-binding nuclear protein rtb2, putative	0.0035	0.0353	0.7942
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0409	0.0409
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0038	0.0409	0.0409
Chlamydia trachomatis	ATP-dependent Clp protease proteolytic subunit	0.0066	0.0975	0.5
Loa Loa (eye worm)	MH2 domain-containing protein	0.0513	1	1
Schistosoma mansoni	ran	0.0035	0.0353	0.0358
Brugia malayi	MH1 domain containing protein	0.0035	0.0355	0.0355
Plasmodium falciparum	importin beta, putative	0.0047	0.0605	0.5883
Brugia malayi	Cation transporter family protein	0.0123	0.2135	0.2135
Echinococcus multilocularis	GPCR, family 2	0.0055	0.0752	0.0763
Loa Loa (eye worm)	glutamate-gated chloride channel alpha3A subunit	0.0038	0.0409	0.0409
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0219	0.4068	0.4068
Loa Loa (eye worm)	LGC-31 protein	0.0038	0.0409	0.0409
Loa Loa (eye worm)	nicotinic acetylcholine receptor non-alpha subunit	0.0038	0.0409	0.0409
Loa Loa (eye worm)	TAR-binding protein	0.0219	0.4068	0.4068
Brugia malayi	MH1 domain containing protein	0.0035	0.0355	0.0355
Echinococcus granulosus	smad	0.0035	0.0355	0.036
Brugia malayi	MH1 domain containing protein	0.0019	0.004	0.004
Loa Loa (eye worm)	hypothetical protein	0.002	0.0059	0.0059
Schistosoma mansoni	nAChR subunit	0.0038	0.0409	0.0416
Echinococcus granulosus	TGF beta signal transducer SmadC	0.0035	0.0355	0.036
Onchocerca volvulus		0.0026	0.0184	0.0473
Trichomonas vaginalis	set domain proteins, putative	0.021	0.3892	1
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0026	0.0165	0.0167
Loa Loa (eye worm)	ligand-Gated ion Channel family member	0.0038	0.0409	0.0409
Echinococcus multilocularis	nicotinic acetylcholine receptor alpha subunit	0.0038	0.0409	0.0416
Echinococcus multilocularis	Smad4	0.0035	0.0355	0.036
Mycobacterium ulcerans	ATP-dependent Clp protease proteolytic subunit	0.0066	0.0975	0.5
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0026	0.0184	0.1197
Brugia malayi	GTP-binding nuclear protein RAN/TC4	0.0035	0.0353	0.0353
Echinococcus granulosus	Cys loop ligand gated ion channel subunit	0.0038	0.0409	0.0416
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0409	0.0409
Toxoplasma gondii	HEAT repeat-containing protein	0.0047	0.0605	0.5883
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0055	0.0752	0.0752
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0026	0.0184	0.0187
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0038	0.0424	0.0202
Echinococcus multilocularis	Cys loop ligand gated ion channel subunit	0.0038	0.0409	0.0416
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0026	0.0184	0.0187
Onchocerca volvulus		0.0123	0.2135	0.5484
Echinococcus granulosus	histone lysine methyltransferase setb	0.0026	0.0184	0.0187
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0081	0.1286	0.1306
Brugia malayi	acetylcholine receptor protein, alpha-like chain, putative	0.0038	0.0409	0.0409
Onchocerca volvulus		0.0038	0.0409	0.1052
Loa Loa (eye worm)	nuclear factor I	0.0019	0.004	0.004
Echinococcus granulosus	GTP binding nuclear protein Ran	0.0035	0.0353	0.0358
Schistosoma mansoni	nAChR subunit (ShAR1-beta-like)	0.0123	0.2135	0.2167
Schistosoma mansoni	nAChR subunit	0.0038	0.0409	0.0416
Brugia malayi	gamma-aminobutyric-acid receptor beta subunit precursor	0.0038	0.0409	0.0409
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0038	0.0409	0.0409
Echinococcus granulosus	glycine receptor subunit beta	0.0038	0.0409	0.0416
Brugia malayi	RNA, U transporter 1	0.0135	0.2367	0.2367
Loa Loa (eye worm)	hypothetical protein	0.002	0.0059	0.0059
Schistosoma mansoni	nAChR subunit	0.0038	0.0409	0.0416
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.002	0.0059	0.006
Loa Loa (eye worm)	hypothetical protein	0.002	0.0059	0.0059
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0038	0.0409	0.0416
Trypanosoma brucei	importin beta-1 subunit, putative	0.0047	0.0605	1
Loa Loa (eye worm)	hypothetical protein	0.002	0.0059	0.0059
Treponema pallidum	ATP-dependent Clp protease proteolytic subunit	0.0066	0.0975	1
Loa Loa (eye worm)	GTP-binding nuclear protein RAN/TC4	0.0035	0.0353	0.0353
Echinococcus multilocularis	GTP binding nuclear protein Ran	0.0035	0.0353	0.0358
Onchocerca volvulus		0.021	0.3892	1
Plasmodium vivax	SET domain protein, putative	0.0026	0.0184	0.1197
Echinococcus multilocularis	nicotinic acetylcholine receptor subunit alpha 8	0.0038	0.0409	0.0416
Loa Loa (eye worm)	hypothetical protein	0.0066	0.0975	0.0975
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0409	0.0409
Plasmodium falciparum	ATP-dependent Clp protease proteolytic subunit	0.0023	0.0106	0.0328
Brugia malayi	acetylcholine receptor alpha subunit precursor, putative	0.0038	0.0409	0.0409
Mycobacterium leprae	PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2)	0.0066	0.0975	1
Loa Loa (eye worm)	hypothetical protein	0.0118	0.2031	0.2031
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0038	0.0409	0.0409
Loa Loa (eye worm)	RNA binding protein	0.0219	0.4068	0.4068
Schistosoma mansoni	neurotransmitter gated ion channel	0.002	0.0059	0.006
Chlamydia trachomatis	ATP-dependent Clp protease proteolytic subunit	0.0066	0.0975	0.5
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0409	0.0409
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0409	0.0409
Toxoplasma gondii	GTP-binding nuclear protein ran/tc4	0.0035	0.0353	0.3074
Brugia malayi	Cation transporter family protein	0.0038	0.0409	0.0409
Schistosoma mansoni	hypothetical protein	0.0118	0.2031	0.2062
Brugia malayi	RNA recognition motif domain containing protein	0.0219	0.4068	0.4068
Schistosoma mansoni	tar DNA-binding protein	0.0219	0.4068	0.413
Echinococcus multilocularis	snurportin 1	0.0505	0.985	1
Plasmodium falciparum	GTP-binding nuclear protein RAN/TC4	0.0035	0.0353	0.3074
Echinococcus granulosus	mothers against decapentaplegic 5	0.0035	0.0355	0.036

Activities

Activity type	Activity value	Assay description	Source	Reference
Activity (functional)	= 0 %	Inhibition of nicotine-induced antinociception in acute pain mouse model at 10 ug/kg, sc by tail flick method	ChEMBL.	17964169
Activity (functional)	= 0 %	Inhibition of nicotine-induced antinociception in acute pain mouse model at 10 ug/kg, sc by hot plate method	ChEMBL.	17964169
Activity (functional)	= 0 %	Inhibition of nicotine-induced antinociception in acute pain mouse model at 10 ug/kg, sc by tail flick method	ChEMBL.	17964169
Activity (functional)	= 0 %	Inhibition of nicotine-induced antinociception in acute pain mouse model at 10 ug/kg, sc by hot plate method	ChEMBL.	17964169
Activity (functional)	= 1 %	Antinociceptive activity in acute pain mouse model at 10 mg/kg, sc by tail flick method	ChEMBL.	17964169
Activity (functional)	= 1 %	Antinociceptive activity in acute pain mouse model at 10 mg/kg, sc by tail flick method	ChEMBL.	17964169
Activity (functional)	= 2 %	Antinociceptive activity in mouse assessed as inhibition of nicotin induced hypothermia at 10 mg/kg, sc	ChEMBL.	17964169
Activity (functional)	= 2 %	Antinociceptive activity in mouse assessed as inhibition of nicotin induced hypothermia at 10 mg/kg, sc	ChEMBL.	17964169
Activity (functional)	= 5 %	Effect on rectal temperature in mouse at 1000 mg/kg, sc	ChEMBL.	17964169
Activity (functional)	= 5 %	Effect on rectal temperature in mouse at 1000 mg/kg, sc	ChEMBL.	17964169
Activity (functional)	= 11 %	Antinociceptive activity in acute pain mouse model at 10 mg/kg, sc by hot plate method	ChEMBL.	17964169
Activity (functional)	= 11 %	Antinociceptive activity in acute pain mouse model at 10 mg/kg, sc by hot plate method	ChEMBL.	17964169
ED50 (functional)	= 10.5 mg kg-1	Effect on locomotor activity in sc dosed mouse assessed as spontaneous activity	ChEMBL.	17964169
ED50 (functional)	= 10.5 mg kg-1	Effect on locomotor activity in sc dosed mouse assessed as spontaneous activity	ChEMBL.	17964169
Ki (binding)	= 0.21 nM	Displacement of [3H]epibatidine from alpha4beta2 nAChR in rat cerebral cortex	ChEMBL.	17964169
Ki (binding)	= 0.21 nM	Displacement of [3H]epibatidine from alpha4beta2 nAChR in rat cerebral cortex	ChEMBL.	17964169
Ki (binding)	> 2000 nM	Displacement of [125I]iodoMLA from alpha7 nAChR in rat cerebral cortex	ChEMBL.	17964169
Ki (binding)	> 2000 nM	Displacement of [125I]iodoMLA from alpha7 nAChR in rat cerebral cortex	ChEMBL.	17964169

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: CHEMBL406222

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 515533