TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 404.286 | Formula: C21H19Cl2NO3
H donors: 0 H acceptors: 2 LogP: 5.86 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: CCOC(=O)c1ccc2c(c1)c1OCCCc1c(n2)c1ccc(cc1)Cl.Cl
InChi: 1S/C21H18ClNO3.ClH/c1-2-25-21(24)14-7-10-18-17(12-14)20-16(4-3-11-26-20)19(23-18)13-5-8-15(22)9-6-13;/h5-10,12H,2-4,11H2,1H3;1H
InChiKey: HEHIGVHKQZLNMW-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
Homo sapiens	butyrylcholinesterase	Starlite/ChEMBL	References
Bos taurus	Acetylcholinesterase	Starlite/ChEMBL	References
Homo sapiens	acetylcholinesterase (Yt blood group)	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Echinococcus granulosus	acetylcholinesterase	Get druggable targets OG5_126875	All targets in OG5_126875
Schistosoma japonicum	ko:K01049 acetylcholinesterase [EC3.1.1.7], putative	Get druggable targets OG5_126875	All targets in OG5_126875
Schistosoma japonicum	Acetylcholinesterase 1 precursor, putative	Get druggable targets OG5_126875	All targets in OG5_126875
Loa Loa (eye worm)	acetylcholinesterase 1	Get druggable targets OG5_126875	All targets in OG5_126875
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_126875	All targets in OG5_126875
Brugia malayi	Carboxylesterase family protein	Get druggable targets OG5_126875	All targets in OG5_126875
Echinococcus multilocularis	acetylcholinesterase	Get druggable targets OG5_126875	All targets in OG5_126875
Echinococcus multilocularis	carboxylesterase 5A	Get druggable targets OG5_126875	All targets in OG5_126875
Echinococcus multilocularis	acetylcholinesterase	Get druggable targets OG5_126875	All targets in OG5_126875
Loa Loa (eye worm)	carboxylesterase	Get druggable targets OG5_126875	All targets in OG5_126875
Brugia malayi	Carboxylesterase family protein	Get druggable targets OG5_126875	All targets in OG5_126875
Echinococcus granulosus	carboxylesterase 5A	Get druggable targets OG5_126875	All targets in OG5_126875
Echinococcus granulosus	acetylcholinesterase	Get druggable targets OG5_126875	All targets in OG5_126875
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_126875	All targets in OG5_126875
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	Get druggable targets OG5_126875	All targets in OG5_126875

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Drosophila melanogaster	CG10175 gene product from transcript CG10175-RE	Acetylcholinesterase	613 aa	527 aa	32.3 %
Loa Loa (eye worm)	hypothetical protein	Acetylcholinesterase	613 aa	561 aa	24.6 %
Brugia malayi	Carboxylesterase family protein	acetylcholinesterase (Yt blood group)	614 aa	510 aa	26.5 %
Onchocerca volvulus		Acetylcholinesterase	613 aa	613 aa	26.8 %
Brugia malayi	Carboxylesterase family protein	Acetylcholinesterase	613 aa	569 aa	31.3 %
Onchocerca volvulus		Acetylcholinesterase	613 aa	552 aa	31.3 %
Brugia malayi	Carboxylesterase family protein	Acetylcholinesterase	613 aa	491 aa	26.7 %
Echinococcus multilocularis	neuroligin	Acetylcholinesterase	613 aa	534 aa	23.2 %
Onchocerca volvulus	Carnitine O-palmitoyltransferase 2, mitochondrial homolog	Acetylcholinesterase	613 aa	511 aa	39.9 %
Echinococcus granulosus	BC026374 protein S09 family	Acetylcholinesterase	613 aa	627 aa	34.0 %
Echinococcus multilocularis	BC026374 protein (S09 family)	Acetylcholinesterase	613 aa	627 aa	33.8 %
Onchocerca volvulus	Molybdopterin synthase catalytic subunit homolog	Acetylcholinesterase	613 aa	564 aa	30.3 %
Brugia malayi	Carboxylesterase family protein	butyrylcholinesterase	602 aa	546 aa	30.2 %
Loa Loa (eye worm)	hypothetical protein	Acetylcholinesterase	613 aa	573 aa	26.5 %
Onchocerca volvulus		Acetylcholinesterase	613 aa	565 aa	26.0 %
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	Acetylcholinesterase	613 aa	601 aa	23.6 %
Onchocerca volvulus	Putative nuclear protein	Acetylcholinesterase	613 aa	572 aa	41.6 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Onchocerca volvulus		0.0045	0.1447	1
Loa Loa (eye worm)	TYRA-2 protein	0.0045	0.1447	0.1447
Echinococcus granulosus	rhodopsin orphan GPCR	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Echinococcus granulosus	neuropeptide s receptor	0.0045	0.1447	0.1447
Echinococcus granulosus	para nitrobenzyl esterase	0.0041	0.1304	0.1304
Brugia malayi	Carboxylesterase family protein	0.0041	0.1304	0.1304
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0045	0.1447	0.1447
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0045	0.1447	0.1447
Brugia malayi	ORL1-like opioid receptor	0.0045	0.1447	0.1447
Schistosoma mansoni	voltage-gated potassium channel	0.0041	0.1287	0.1287
Brugia malayi	Carboxylesterase family protein	0.0041	0.1304	0.1304
Onchocerca volvulus		0.0045	0.1447	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0041	0.1304	0.1304
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0045	0.1447	0.1447
Echinococcus multilocularis	neuropeptide receptor A26	0.0045	0.1447	0.1447
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Schistosoma mansoni	acetylcholinesterase	0.0041	0.1304	0.1304
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0041	0.1304	0.1304
Schistosoma mansoni	biogenic amine receptor	0.0045	0.1447	0.1447
Echinococcus granulosus	serotonin receptor	0.0045	0.1447	0.1447
Schistosoma mansoni	BC026374 protein (S09 family)	0.0041	0.1304	0.1304
Echinococcus granulosus	g protein coupled receptor	0.0045	0.1447	0.1447
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0045	0.1447	0.1447
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0045	0.1447	0.1447
Echinococcus granulosus	neuropeptide Y receptor	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Echinococcus multilocularis	fmrfamide receptor	0.0045	0.1447	0.1447
Echinococcus multilocularis	allatostatin A receptor	0.0045	0.1447	0.1447
Echinococcus granulosus	g-protein coupled receptor	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0041	0.1304	0.1304
Mycobacterium ulcerans	carboxylesterase, LipT	0.0041	0.1304	0.5
Brugia malayi	hypothetical protein	0.0045	0.1447	0.1447
Schistosoma mansoni	hypothetical protein	0.0045	0.1447	0.1447
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0045	0.1447	0.1447
Schistosoma mansoni	amine GPCR	0.0045	0.1447	0.1447
Brugia malayi	hypothetical protein	0.0045	0.1447	0.1447
Echinococcus multilocularis	somatostatin receptor	0.0045	0.1447	0.1447
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0045	0.1447	0.1447
Schistosoma mansoni	neuroligin 3 (S09 family)	0.0041	0.1304	0.1304
Echinococcus granulosus	rhodopsin orphan GPCR	0.0045	0.1447	0.1447
Echinococcus multilocularis	g protein coupled receptor	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0045	0.1447	0.1447
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0041	0.1304	0.1304
Echinococcus granulosus	tm gpcr rhodopsin	0.0045	0.1447	0.1447
Echinococcus multilocularis	serotonin receptor	0.0045	0.1447	0.1447
Echinococcus granulosus	acetylcholinesterase	0.0246	1	1
Brugia malayi	hypothetical protein	0.0041	0.1304	0.1304
Echinococcus granulosus	orexin receptor type 2	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0041	0.1304	0.1304
Echinococcus multilocularis	G protein coupled receptor 139	0.0045	0.1447	0.1447
Echinococcus granulosus	hypothetical protein	0.0045	0.1447	0.1447
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.0038	0.1139	0.1139
Brugia malayi	G-protein coupled receptor	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Echinococcus granulosus	somatostatin receptor	0.0045	0.1447	0.1447
Brugia malayi	Carboxylesterase family protein	0.0041	0.1304	0.1304
Echinococcus multilocularis	sex peptide receptor	0.0045	0.1447	0.1447
Echinococcus multilocularis	neuropeptides capa receptor	0.0045	0.1447	0.1447
Loa Loa (eye worm)	G-protein coupled receptor	0.0045	0.1447	0.1447
Onchocerca volvulus		0.0045	0.1447	1
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0045	0.1447	0.1447
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0045	0.1447	0.1447
Brugia malayi	Serotonin receptor	0.0045	0.1447	0.1447
Schistosoma mansoni	histamine h1 receptor	0.0045	0.1447	0.1447
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0045	0.1447	0.1447
Echinococcus granulosus	rhodopsin orphan GPCR	0.0045	0.1447	0.1447
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0045	0.1447	0.1447
Brugia malayi	RE15519p	0.0045	0.1447	0.1447
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Onchocerca volvulus		0.0045	0.1447	1
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0927	0.0927
Brugia malayi	Melatonin receptor type 1A	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0041	0.1304	0.5
Echinococcus multilocularis	para nitrobenzyl esterase	0.0041	0.1304	0.1304
Schistosoma mansoni	myosin xvIII	0.0045	0.1447	0.1447
Onchocerca volvulus		0.0045	0.1447	1
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0045	0.1447	0.1447
Echinococcus granulosus	g protein coupled receptor	0.0045	0.1447	0.1447
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0045	0.1447	0.1447
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0045	0.1447	0.1447
Trichomonas vaginalis	spcc417.12 protein, putative	0.0041	0.1304	1
Echinococcus granulosus	family S9 non peptidase ue S09 family	0.0041	0.1304	0.1304
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0045	0.1447	0.1447
Echinococcus granulosus	acetylcholinesterase	0.0246	1	1
Brugia malayi	neuropeptide F receptor	0.0045	0.1447	0.1447
Brugia malayi	hypothetical protein	0.0045	0.1447	0.1447
Loa Loa (eye worm)	melatonin receptor type 1A	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Echinococcus granulosus	tm gpcr rhodopsin	0.0045	0.1447	0.1447
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0045	0.1447	0.1447
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0045	0.1447	0.1447
Echinococcus granulosus	rhodopsin orphan GPCR	0.0045	0.1447	0.1447
Schistosoma mansoni	amine GPCR	0.0045	0.1447	0.1447
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.0038	0.1139	0.1139
Echinococcus granulosus	7TM GPCR rhodopsin	0.0045	0.1447	0.1447
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0045	0.1447	0.1447
Echinococcus granulosus	sex peptide receptor	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Schistosoma mansoni	neuropeptide receptor	0.0045	0.1447	0.1447
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0045	0.1447	0.1447
Echinococcus multilocularis	neuropeptide Y receptor	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Echinococcus multilocularis	neuropeptides capa receptor	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0041	0.1304	0.1304
Echinococcus granulosus	BC026374 protein S09 family	0.0041	0.1304	0.1304
Brugia malayi	follicle stimulating hormone receptor	0.0045	0.1447	0.1447
Onchocerca volvulus		0.0045	0.1447	1
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Onchocerca volvulus		0.0045	0.1447	1
Schistosoma mansoni	neuropeptide F-like receptor	0.0045	0.1447	0.1447
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0041	0.1304	0.1304
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Echinococcus multilocularis	g protein coupled receptor	0.0045	0.1447	0.1447
Echinococcus multilocularis	serotonin receptor	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0038	0.1139	0.1139
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0045	0.1447	0.1447
Brugia malayi	Dopamine receptor protein 1	0.0045	0.1447	0.1447
Brugia malayi	Carboxylesterase family protein	0.0246	1	1
Echinococcus granulosus	allatostatin A receptor	0.0045	0.1447	0.1447
Brugia malayi	hypothetical protein	0.0045	0.1447	0.1447
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0045	0.1447	0.1447
Schistosoma mansoni	hypothetical protein	0.0045	0.1447	0.1447
Schistosoma mansoni	opsin-like receptor	0.0045	0.1447	0.1447
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0041	0.1304	0.1304
Echinococcus granulosus	neuropeptide Y receptor	0.0045	0.1447	0.1447
Schistosoma mansoni	opsin-like receptor	0.0045	0.1447	0.1447
Schistosoma mansoni	neuropeptide F-like receptor	0.0045	0.1447	0.1447
Brugia malayi	neuropeptide F receptor	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Echinococcus granulosus	fmrfamide receptor	0.0045	0.1447	0.1447
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0045	0.1447	0.1447
Echinococcus granulosus	carboxylesterase 5A	0.0246	1	1
Onchocerca volvulus		0.0045	0.1447	1
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0045	0.1447	0.1447
Echinococcus granulosus	neuropeptide FF receptor 2	0.0045	0.1447	0.1447
Echinococcus multilocularis	BC026374 protein (S09 family)	0.0041	0.1304	0.1304
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0045	0.1447	0.1447
Schistosoma mansoni	biogenic amine receptor	0.0045	0.1447	0.1447
Trichomonas vaginalis	carboxylesterase domain containing protein, putative	0.0041	0.1304	1
Schistosoma mansoni	neuropeptide receptor	0.0045	0.1447	0.1447
Echinococcus multilocularis	orexin receptor type 2	0.0045	0.1447	0.1447
Brugia malayi	Carboxylesterase family protein	0.0041	0.1304	0.1304
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Onchocerca volvulus	Neuropeptide F receptor homolog	0.0045	0.1447	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0045	0.1447	0.1447
Brugia malayi	hypothetical protein	0.0045	0.1447	0.1447
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.0045	0.1447	0.1447
Echinococcus granulosus	g protein coupled receptor	0.0045	0.1447	0.1447
Brugia malayi	hypothetical protein	0.0045	0.1447	0.1447
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0045	0.1447	0.1447
Loa Loa (eye worm)	carboxylesterase	0.0246	1	1
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Brugia malayi	putative neuropeptide receptor	0.0045	0.1447	0.1447
Brugia malayi	Dopamine receptor	0.0045	0.1447	0.1447
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0045	0.1447	0.1447
Schistosoma mansoni	gliotactin	0.0041	0.1304	0.1304
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0045	0.1447	0.1447
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0045	0.1447	0.1447
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0045	0.1447	0.1447
Onchocerca volvulus		0.0045	0.1447	1
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0045	0.1447	0.1447
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0045	0.1447	0.1447
Brugia malayi	Serotonin receptor	0.0045	0.1447	0.1447
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0045	0.1447	0.1447
Echinococcus granulosus	rhodopsin orphan GPCR	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Schistosoma mansoni	growth hormone secretagogue receptor	0.0045	0.1447	0.1447
Onchocerca volvulus		0.0045	0.1447	1
Echinococcus granulosus	neuropeptide receptor	0.0045	0.1447	0.1447
Loa Loa (eye worm)	carboxylesterase	0.0041	0.1304	0.1304
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0045	0.1447	0.1447
Schistosoma mansoni	hypothetical protein	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0246	1	1
Brugia malayi	G protein-coupled receptor	0.0045	0.1447	0.1447
Schistosoma mansoni	biogenic amine receptor	0.0045	0.1447	0.1447
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0045	0.1447	0.1447
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0041	0.1304	0.1304
Echinococcus granulosus	neuropeptide receptor	0.0045	0.1447	0.1447
Echinococcus granulosus	tm gpcr rhodopsin	0.0045	0.1447	0.1447
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0041	0.1304	0.5
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Echinococcus multilocularis	g-protein coupled receptor	0.0045	0.1447	0.1447
Schistosoma mansoni	adenoreceptor	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0246	1	1
Echinococcus multilocularis	neuropeptide Y receptor	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Echinococcus multilocularis	family S9 non peptidase ue (S09 family)	0.0041	0.1304	0.1304
Onchocerca volvulus		0.0045	0.1447	1
Onchocerca volvulus		0.0045	0.1447	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Loa Loa (eye worm)	acetylcholinesterase 1	0.0246	1	1
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0045	0.1447	0.1447
Brugia malayi	G protein-coupled receptor F59B2.13	0.0045	0.1447	0.1447
Onchocerca volvulus		0.0045	0.1447	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0045	0.1447	0.1447
Onchocerca volvulus		0.0045	0.1447	1
Echinococcus multilocularis	acetylcholinesterase	0.0246	1	1
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0045	0.1447	0.1447
Echinococcus granulosus	neuroligin	0.0041	0.1304	0.1304
Loa Loa (eye worm)	neuropeptide F receptor	0.0045	0.1447	0.1447
Echinococcus multilocularis	neuropeptide s receptor	0.0045	0.1447	0.1447
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0045	0.1447	0.1447
Echinococcus granulosus	neuropeptides capa receptor	0.0045	0.1447	0.1447
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0045	0.1447	0.1447
Brugia malayi	Dopamine receptor protein 2	0.0045	0.1447	0.1447
Onchocerca volvulus		0.0045	0.1447	1
Schistosoma mansoni	hypothetical protein	0.0045	0.1447	0.1447
Brugia malayi	AKH receptor	0.0045	0.1447	0.1447
Brugia malayi	larval opioid receptor	0.0045	0.1447	0.1447
Brugia malayi	GnHR receptor homolog	0.0045	0.1447	0.1447
Brugia malayi	sulfakinin receptor protein	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0246	1	1
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0045	0.1447	0.1447
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0045	0.1447	0.1447
Echinococcus multilocularis	acetylcholinesterase	0.0246	1	1
Schistosoma mansoni	amine GPCR	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Echinococcus multilocularis	g protein coupled receptor	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Schistosoma mansoni	amine GPCR	0.0045	0.1447	0.1447
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0045	0.1447	0.1447
Loa Loa (eye worm)	carboxylesterase	0.0041	0.1304	0.1304
Brugia malayi	hypothetical protein	0.0045	0.1447	0.1447
Schistosoma mansoni	opsin-like receptor	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Echinococcus multilocularis	carboxylesterase 5A	0.0246	1	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0045	0.1447	0.1447
Brugia malayi	hypothetical protein	0.0045	0.1447	0.1447
Echinococcus granulosus	biogenic amine 5HT receptor	0.0045	0.1447	0.1447
Brugia malayi	putative neuropeptide receptor NPR1	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0038	0.1139	0.1139
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Schistosoma mansoni	voltage-gated potassium channel	0.0041	0.1287	0.1287
Loa Loa (eye worm)	hypothetical protein	0.0041	0.1304	0.1304
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0045	0.1447	0.1447
Brugia malayi	G-protein coupled receptor	0.0045	0.1447	0.1447
Mycobacterium tuberculosis	Carboxylesterase LipT	0.0041	0.1304	0.5
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0045	0.1447	0.1447
Echinococcus multilocularis	neuroligin	0.0041	0.1304	0.1304
Echinococcus granulosus	dro:myosuppressin receptor	0.0045	0.1447	0.1447
Echinococcus multilocularis	fmrfamide receptor	0.0045	0.1447	0.1447
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0045	0.1447	0.1447
Echinococcus granulosus	G protein coupled receptor 139	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Loa Loa (eye worm)	neuropeptide F receptor	0.0045	0.1447	0.1447
Onchocerca volvulus	Dopamine\/Ecdysteroid receptor homolog	0.0045	0.1447	1
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Echinococcus granulosus	neuropeptide receptor A26	0.0045	0.1447	0.1447
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0045	0.1447	0.1447
Onchocerca volvulus		0.0045	0.1447	1
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0045	0.1447	0.1447
Schistosoma mansoni	amine GPCR	0.0045	0.1447	0.1447
Brugia malayi	hypothetical protein	0.0045	0.1447	0.1447
Schistosoma mansoni	neuropeptide receptor	0.0045	0.1447	0.1447
Brugia malayi	hypothetical protein	0.0045	0.1447	0.1447
Echinococcus multilocularis	neuropeptide receptor	0.0045	0.1447	0.1447
Echinococcus granulosus	biogenic amine 5HT receptor	0.0045	0.1447	0.1447
Echinococcus granulosus	7tm_1 domain containing protein	0.0045	0.1447	0.1447
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0045	0.1447	0.1447
Loa Loa (eye worm)	G-protein coupled receptor	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0045	0.1447	0.1447
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Echinococcus multilocularis	dro:myosuppressin receptor	0.0045	0.1447	0.1447
Echinococcus granulosus	rhodopsin orphan GPCR	0.0045	0.1447	0.1447
Echinococcus granulosus	neuropeptides capa receptor	0.0045	0.1447	0.1447
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1447	0.1447
Schistosoma mansoni	neuropeptide receptor	0.0045	0.1447	0.1447
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.0045	0.1447	0.1447
Onchocerca volvulus		0.0045	0.1447	1
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0045	0.1447	0.1447
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0045	0.1447	0.1447
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0045	0.1447	0.1447
Echinococcus multilocularis	neuropeptide receptor	0.0045	0.1447	0.1447
Echinococcus granulosus	rhodopsin orphan GPCR	0.0045	0.1447	0.1447
Schistosoma mansoni	neuropeptide f receptor 76f	0.0045	0.1447	0.1447
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0045	0.1447	0.1447

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	> 10000 nM	Inhibition of AChE in human erythrocytes by Ellman's method	ChEMBL.	19663388
IC50 (binding)	> 10000 nM	Inhibition of bovine AChE by Ellman's method	ChEMBL.	19663388
IC50 (binding)	> 10000 nM	Inhibition of human serum BChE by Ellman's method	ChEMBL.	19663388

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: CHEMBL550989

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1050391