TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 284.333 | Formula: C15H12N2O2S
H donors: 2 H acceptors: 4 LogP: 3.34 Rotable bonds: 2
Rule of 5 violations (Lipinski): 1
SMILES: Oc1ccc(c(c1)O)c1nnc(s1)c1cccc(c1)C
InChi: 1S/C15H12N2O2S/c1-9-3-2-4-10(7-9)14-16-17-15(20-14)12-6-5-11(18)8-13(12)19/h2-8,18-19H,1H3
InChiKey: LUUBFKSVLSVPHF-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
Electrophorus electricus	Acetylcholinesterase	Starlite/ChEMBL	References
Equus caballus	Cholinesterase	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_126875	All targets in OG5_126875
Echinococcus granulosus	acetylcholinesterase	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)	hypothetical 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
Schistosoma japonicum	Acetylcholinesterase 1 precursor, putative	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
Brugia malayi	Carboxylesterase family protein	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
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	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
Echinococcus multilocularis	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)	acetylcholinesterase 1	Get druggable targets OG5_126875	All targets in OG5_126875
Echinococcus multilocularis	acetylcholinesterase	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
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	Acetylcholinesterase	633 aa	622 aa	24.9 %
Loa Loa (eye worm)	hypothetical protein	Acetylcholinesterase	633 aa	597 aa	25.1 %
Onchocerca volvulus		Cholinesterase	574 aa	578 aa	25.3 %
Onchocerca volvulus		Cholinesterase	574 aa	551 aa	29.9 %
Onchocerca volvulus	Carnitine O-palmitoyltransferase 2, mitochondrial homolog	Cholinesterase	574 aa	554 aa	36.1 %
Onchocerca volvulus	Molybdopterin synthase catalytic subunit homolog	Acetylcholinesterase	633 aa	576 aa	28.8 %
Loa Loa (eye worm)	hypothetical protein	Acetylcholinesterase	633 aa	576 aa	23.4 %
Brugia malayi	Carboxylesterase family protein	Acetylcholinesterase	633 aa	517 aa	25.1 %
Onchocerca volvulus	Putative nuclear protein	Cholinesterase	574 aa	572 aa	40.9 %
Echinococcus multilocularis	neuroligin	Acetylcholinesterase	633 aa	507 aa	23.9 %
Drosophila melanogaster	CG10175 gene product from transcript CG10175-RE	Acetylcholinesterase	633 aa	549 aa	30.4 %
Brugia malayi	Carboxylesterase family protein	Cholinesterase	574 aa	538 aa	31.4 %
Echinococcus granulosus	neuroligin	Cholinesterase	574 aa	492 aa	24.4 %
Echinococcus multilocularis	BC026374 protein (S09 family)	Acetylcholinesterase	633 aa	690 aa	32.3 %
Schistosoma mansoni	gliotactin	Cholinesterase	574 aa	587 aa	27.9 %
Brugia malayi	Carboxylesterase family protein	Acetylcholinesterase	633 aa	620 aa	28.4 %
Echinococcus granulosus	BC026374 protein S09 family	Acetylcholinesterase	633 aa	690 aa	31.7 %
Schistosoma japonicum	ko:K01050 cholinesterase [EC3.1.1.8], putative	Cholinesterase	574 aa	577 aa	36.9 %
Onchocerca volvulus		Acetylcholinesterase	633 aa	648 aa	25.3 %
Onchocerca volvulus	Galectin homolog	Cholinesterase	574 aa	531 aa	39.7 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Brugia malayi	hypothetical protein	0.01	0.5706	0.6027
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.01	0.5706	0.5128
Schistosoma mansoni	neuropeptide receptor	0.01	0.5706	0.5128
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.01	0.5706	0.5128
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.01	0.5706	0.5715
Echinococcus granulosus	tm gpcr rhodopsin	0.01	0.5706	0.5715
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Brugia malayi	hypothetical protein	0.0028	0.1418	0.1497
Brugia malayi	Carboxylesterase family protein	0.0028	0.1418	0.1497
Loa Loa (eye worm)	TYRA-2 protein	0.01	0.5706	0.6027
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Loa Loa (eye worm)	carboxylesterase	0.0164	0.9468	1
Brugia malayi	AKH receptor	0.01	0.5706	0.6027
Echinococcus multilocularis	G protein coupled receptor 139	0.01	0.5706	0.5706
Loa Loa (eye worm)	neuropeptide F receptor	0.01	0.5706	0.6027
Echinococcus granulosus	neuroligin	0.0028	0.1418	0.142
Echinococcus multilocularis	allatostatin A receptor	0.01	0.5706	0.5706
Onchocerca volvulus		0.01	0.5706	1
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.01	0.5706	0.5706
Brugia malayi	Tachykinin-like peptides receptor 99D	0.01	0.5706	0.6027
Schistosoma mansoni	transient receptor potential cation channel subfamily A member	0.0169	0.9781	1
Echinococcus granulosus	neuropeptide Y receptor	0.01	0.5706	0.5715
Echinococcus granulosus	serotonin receptor	0.01	0.5706	0.5715
Echinococcus multilocularis	neuropeptide receptor A26	0.01	0.5706	0.5706
Echinococcus granulosus	neuropeptides capa receptor	0.01	0.5706	0.5715
Echinococcus granulosus	acetylcholinesterase	0.0164	0.9468	0.9482
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Brugia malayi	neuropeptide F receptor	0.01	0.5706	0.6027
Brugia malayi	GnHR receptor homolog	0.01	0.5706	0.6027
Echinococcus multilocularis	neuropeptides capa receptor	0.01	0.5706	0.5706
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0028	0.1418	0.5
Echinococcus multilocularis	rhodopsin orphan GPCR	0.01	0.5706	0.5706
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.01	0.5706	0.5706
Schistosoma mansoni	amine GPCR	0.01	0.5706	0.5128
Echinococcus multilocularis	rhodopsin orphan GPCR	0.01	0.5706	0.5706
Onchocerca volvulus		0.01	0.5706	1
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.01	0.5706	0.5715
Echinococcus multilocularis	rhodopsin orphan GPCR	0.01	0.5706	0.5706
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.01	0.5706	0.6027
Onchocerca volvulus	Dopamine\/Ecdysteroid receptor homolog	0.01	0.5706	1
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Echinococcus granulosus	rhodopsin orphan GPCR	0.01	0.5706	0.5715
Schistosoma mansoni	neuropeptide F-like receptor	0.01	0.5706	0.5128
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Echinococcus multilocularis	neuropeptide receptor	0.01	0.5706	0.5706
Echinococcus multilocularis	BC026374 protein (S09 family)	0.0028	0.1418	0.1418
Brugia malayi	Carboxylesterase family protein	0.0164	0.9468	1
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.01	0.5706	0.5128
Echinococcus granulosus	BC026374 protein S09 family	0.0028	0.1418	0.142
Echinococcus granulosus	neuropeptide Y receptor	0.01	0.5706	0.5715
Echinococcus granulosus	rhodopsin orphan GPCR	0.01	0.5706	0.5715
Onchocerca volvulus		0.01	0.5706	1
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.01	0.5706	0.6027
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Echinococcus granulosus	fmrfamide receptor	0.01	0.5706	0.5715
Echinococcus multilocularis	neuropeptide receptor	0.01	0.5706	0.5706
Brugia malayi	Carboxylesterase family protein	0.0028	0.1418	0.1497
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.01	0.5706	0.6027
Brugia malayi	follicle stimulating hormone receptor	0.01	0.5706	0.6027
Echinococcus multilocularis	neuroligin	0.0028	0.1418	0.1418
Brugia malayi	Dopamine receptor protein 1	0.01	0.5706	0.6027
Onchocerca volvulus		0.01	0.5706	1
Loa Loa (eye worm)	hypothetical protein	0.0164	0.9468	1
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.01	0.5706	0.5128
Schistosoma mansoni	growth hormone secretagogue receptor	0.01	0.5706	0.5128
Echinococcus multilocularis	dro:myosuppressin receptor	0.01	0.5706	0.5706
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.01	0.5706	0.5715
Echinococcus granulosus	7tm_1 domain containing protein	0.01	0.5706	0.5715
Loa Loa (eye worm)	melatonin receptor type 1A	0.01	0.5706	0.6027
Echinococcus granulosus	hypothetical protein	0.01	0.5706	0.5715
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Brugia malayi	Carboxylesterase family protein	0.0164	0.9468	1
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Echinococcus multilocularis	carboxylesterase 5A	0.0164	0.9468	0.9468
Brugia malayi	G protein-coupled receptor F59B2.13	0.01	0.5706	0.6027
Schistosoma mansoni	amine GPCR	0.01	0.5706	0.5128
Brugia malayi	Dopamine receptor	0.01	0.5706	0.6027
Schistosoma mansoni	opsin-like receptor	0.01	0.5706	0.5128
Loa Loa (eye worm)	hypothetical protein	0.0028	0.1418	0.1497
Echinococcus granulosus	allatostatin A receptor	0.01	0.5706	0.5715
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Onchocerca volvulus		0.01	0.5706	1
Echinococcus granulosus	alpha 1A adrenergic receptor	0.01	0.5706	0.5715
Trichomonas vaginalis	spcc417.12 protein, putative	0.0028	0.1418	0.5
Echinococcus multilocularis	acetylcholinesterase	0.0164	0.9468	0.9468
Schistosoma mansoni	neuropeptide receptor	0.01	0.5706	0.5128
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0028	0.1418	0.5
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Echinococcus multilocularis	sex peptide receptor	0.01	0.5706	0.5706
Echinococcus granulosus	g protein coupled receptor	0.01	0.5706	0.5715
Schistosoma mansoni	amine GPCR	0.01	0.5706	0.5128
Echinococcus granulosus	rhodopsin orphan GPCR	0.01	0.5706	0.5715
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.01	0.5706	0.5128
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.01	0.5706	0.5715
Onchocerca volvulus		0.01	0.5706	1
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Brugia malayi	hypothetical protein	0.01	0.5706	0.6027
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.01	0.5706	0.6027
Brugia malayi	hypothetical protein	0.01	0.5706	0.6027
Schistosoma mansoni	biogenic amine receptor	0.01	0.5706	0.5128
Schistosoma mansoni	hypothetical protein	0.01	0.5706	0.5128
Echinococcus granulosus	sex peptide receptor	0.01	0.5706	0.5715
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.01	0.5706	0.5128
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.01	0.5706	0.5715
Echinococcus granulosus	rhodopsin orphan GPCR	0.01	0.5706	0.5715
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.01	0.5706	0.5128
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Brugia malayi	hypothetical protein	0.01	0.5706	0.6027
Echinococcus granulosus	7TM GPCR rhodopsin	0.01	0.5706	0.5715
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Echinococcus multilocularis	fmrfamide receptor	0.01	0.5706	0.5706
Echinococcus multilocularis	somatostatin receptor	0.01	0.5706	0.5706
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Echinococcus granulosus	neuropeptide receptor	0.01	0.5706	0.5715
Echinococcus multilocularis	serotonin receptor	0.01	0.5706	0.5706
Loa Loa (eye worm)	hypothetical protein	0.0028	0.1418	0.1497
Onchocerca volvulus		0.01	0.5706	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.01	0.5706	0.5715
Loa Loa (eye worm)	carboxylesterase	0.0028	0.1418	0.1497
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Echinococcus multilocularis	rhodopsin orphan GPCR	0.01	0.5706	0.5706
Brugia malayi	neuropeptide F receptor	0.01	0.5706	0.6027
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Echinococcus multilocularis	rhodopsin orphan GPCR	0.01	0.5706	0.5706
Echinococcus multilocularis	neuropeptide s receptor	0.01	0.5706	0.5706
Echinococcus granulosus	rhodopsin orphan GPCR	0.01	0.5706	0.5715
Brugia malayi	G-protein coupled receptor	0.01	0.5706	0.6027
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.01	0.5706	0.5706
Schistosoma mansoni	amine GPCR	0.01	0.5706	0.5128
Echinococcus granulosus	orexin receptor type 2	0.01	0.5706	0.5715
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.01	0.5706	0.5128
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.01	0.5706	0.5706
Brugia malayi	Dopamine receptor protein 2	0.01	0.5706	0.6027
Echinococcus granulosus	peptide allatostatin:somatostatin	0.01	0.5706	0.5715
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.01	0.5706	0.6027
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Echinococcus granulosus	neuropeptides capa receptor	0.01	0.5706	0.5715
Schistosoma mansoni	biogenic amine (5HT) receptor	0.01	0.5706	0.5128
Brugia malayi	hypothetical protein	0.01	0.5706	0.6027
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Echinococcus granulosus	carboxylesterase 5A	0.0164	0.9468	0.9482
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Brugia malayi	hypothetical protein	0.01	0.5706	0.6027
Schistosoma mansoni	neuropeptide F-like receptor	0.01	0.5706	0.5128
Echinococcus multilocularis	orexin receptor type 2	0.01	0.5706	0.5706
Echinococcus granulosus	biogenic amine 5HT receptor	0.01	0.5706	0.5715
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.01	0.5706	0.6027
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.01	0.5706	0.5128
Schistosoma mansoni	hypothetical protein	0.01	0.5706	0.5128
Loa Loa (eye worm)	hypothetical protein	0.0028	0.1418	0.1497
Brugia malayi	hypothetical protein	0.01	0.5706	0.6027
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Echinococcus multilocularis	acetylcholinesterase	0.0164	0.9468	0.9468
Schistosoma mansoni	hypothetical protein	0.01	0.5706	0.5128
Echinococcus granulosus	G protein coupled receptor 139	0.01	0.5706	0.5715
Echinococcus multilocularis	neuropeptides capa receptor	0.01	0.5706	0.5706
Mycobacterium ulcerans	carboxylesterase, LipT	0.0028	0.1418	0.5
Brugia malayi	larval opioid receptor	0.01	0.5706	0.6027
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.01	0.5706	0.5128
Brugia malayi	Melatonin receptor type 1A	0.01	0.5706	0.6027
Onchocerca volvulus		0.01	0.5706	1
Echinococcus granulosus	acetylcholinesterase	0.0164	0.9468	0.9482
Echinococcus multilocularis	g protein coupled receptor	0.01	0.5706	0.5706
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.01	0.5706	0.5128
Echinococcus granulosus	neuropeptide FF receptor 2	0.01	0.5706	0.5715
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Schistosoma mansoni	hypothetical protein	0.01	0.5706	0.5128
Schistosoma mansoni	alpha-1 adrenergic receptor	0.01	0.5706	0.5128
Trichomonas vaginalis	carboxylesterase domain containing protein, putative	0.0028	0.1418	0.5
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.01	0.5706	0.5128
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.01	0.5706	0.6027
Onchocerca volvulus		0.01	0.5706	1
Schistosoma mansoni	biogenic amine receptor	0.01	0.5706	0.5128
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.01	0.5706	0.6027
Schistosoma mansoni	opsin-like receptor	0.01	0.5706	0.5128
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.01	0.5706	0.5128
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.01	0.5706	0.5706
Onchocerca volvulus		0.01	0.5706	1
Onchocerca volvulus		0.01	0.5706	1
Loa Loa (eye worm)	hypothetical protein	0.0028	0.1418	0.1497
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Echinococcus granulosus	tm gpcr rhodopsin	0.01	0.5706	0.5715
Echinococcus granulosus	neuropeptide s receptor	0.01	0.5706	0.5715
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Echinococcus multilocularis	g protein coupled receptor	0.01	0.5706	0.5706
Schistosoma mansoni	neuropeptide receptor	0.01	0.5706	0.5128
Echinococcus granulosus	ankyrin repeat protein	0.0169	0.9781	0.9796
Echinococcus granulosus	g protein coupled receptor	0.01	0.5706	0.5715
Echinococcus multilocularis	g-protein coupled receptor	0.01	0.5706	0.5706
Onchocerca volvulus		0.01	0.5706	1
Schistosoma mansoni	amine GPCR	0.01	0.5706	0.5128
Loa Loa (eye worm)	G-protein coupled receptor	0.01	0.5706	0.6027
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.01	0.5706	0.5128
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.01	0.5706	0.5706
Schistosoma mansoni	biogenic amine (5HT) receptor	0.01	0.5706	0.5128
Loa Loa (eye worm)	hypothetical protein	0.0028	0.1418	0.1497
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Onchocerca volvulus	Neuropeptide F receptor homolog	0.01	0.5706	1
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.01	0.5706	0.6027
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Echinococcus granulosus	family S9 non peptidase ue S09 family	0.0028	0.1418	0.142
Echinococcus multilocularis	g protein coupled receptor	0.01	0.5706	0.5706
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.01	0.5706	0.5706
Loa Loa (eye worm)	carboxylesterase	0.0028	0.1418	0.1497
Echinococcus multilocularis	neuropeptide Y receptor	0.01	0.5706	0.5706
Echinococcus multilocularis	rhodopsin orphan GPCR	0.01	0.5706	0.5706
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Echinococcus granulosus	g-protein coupled receptor	0.01	0.5706	0.5715
Echinococcus multilocularis	neuropeptide Y receptor	0.01	0.5706	0.5706
Echinococcus multilocularis	neuropeptide FF receptor 2	0.01	0.5706	0.5706
Brugia malayi	Carboxylesterase family protein	0.0028	0.1418	0.1497
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Loa Loa (eye worm)	neuropeptide F receptor	0.01	0.5706	0.6027
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Onchocerca volvulus		0.01	0.5706	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.01	0.5706	0.5715
Echinococcus granulosus	tm gpcr rhodopsin	0.01	0.5706	0.5715
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.01	0.5706	0.5128
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.01	0.5706	0.5128
Echinococcus multilocularis	ankyrin repeat protein	0.0169	0.9781	0.9781
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.01	0.5706	0.5706
Schistosoma mansoni	biogenic amine receptor	0.01	0.5706	0.5128
Onchocerca volvulus		0.01	0.5706	1
Echinococcus multilocularis	family S9 non peptidase ue (S09 family)	0.0028	0.1418	0.1418
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.01	0.5706	0.5128
Schistosoma mansoni	neuropeptide f receptor 76f	0.01	0.5706	0.5128
Schistosoma mansoni	myosin xvIII	0.01	0.5706	0.5128
Brugia malayi	hypothetical protein	0.01	0.5706	0.6027
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.01	0.5706	0.5715
Loa Loa (eye worm)	acetylcholinesterase 1	0.0164	0.9468	1
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Brugia malayi	G-protein coupled receptor	0.01	0.5706	0.6027
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.01	0.5706	0.5706
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Brugia malayi	hypothetical protein	0.01	0.5706	0.6027
Loa Loa (eye worm)	hypothetical protein	0.0164	0.9468	1
Brugia malayi	hypothetical protein	0.01	0.5706	0.6027
Brugia malayi	Serotonin receptor	0.01	0.5706	0.6027
Echinococcus granulosus	neuropeptide receptor A26	0.01	0.5706	0.5715
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.01	0.5706	0.6027
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0164	0.9468	0.9625
Echinococcus granulosus	g protein coupled receptor	0.01	0.5706	0.5715
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.01	0.5706	0.5128
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.01	0.5706	0.5128
Brugia malayi	Serotonin receptor	0.01	0.5706	0.6027
Schistosoma mansoni	histamine h1 receptor	0.01	0.5706	0.5128
Mycobacterium tuberculosis	Carboxylesterase LipT	0.0028	0.1418	0.5
Onchocerca volvulus		0.01	0.5706	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.01	0.5706	0.5706
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.01	0.5706	0.5706
Echinococcus granulosus	para nitrobenzyl esterase	0.0028	0.1418	0.142
Echinococcus granulosus	neuropeptide receptor	0.01	0.5706	0.5715
Brugia malayi	sulfakinin receptor protein	0.01	0.5706	0.6027
Echinococcus multilocularis	para nitrobenzyl esterase	0.0028	0.1418	0.1418
Brugia malayi	ORL1-like opioid receptor	0.01	0.5706	0.6027
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.01	0.5706	0.5706
Onchocerca volvulus		0.01	0.5706	1
Echinococcus multilocularis	G-protein coupled receptor, putative	0.01	0.5706	0.5706
Loa Loa (eye worm)	G-protein coupled receptor	0.01	0.5706	0.6027
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Echinococcus granulosus	biogenic amine 5HT receptor	0.01	0.5706	0.5715
Echinococcus granulosus	somatostatin receptor	0.01	0.5706	0.5715
Brugia malayi	G protein-coupled receptor	0.01	0.5706	0.6027
Schistosoma mansoni	neuropeptide receptor	0.01	0.5706	0.5128
Echinococcus granulosus	transient receptor potential cation channel	0.0172	0.9985	1
Echinococcus multilocularis	fmrfamide receptor	0.01	0.5706	0.5706
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.01	0.5706	0.5706
Brugia malayi	Carboxylesterase family protein	0.0028	0.1418	0.1497
Echinococcus granulosus	dro:myosuppressin receptor	0.01	0.5706	0.5715
Onchocerca volvulus		0.01	0.5706	1
Brugia malayi	putative neuropeptide receptor	0.01	0.5706	0.6027
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.01	0.5706	0.5706
Loa Loa (eye worm)	hypothetical protein	0.0028	0.1418	0.1497
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.01	0.5706	0.5128
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.01	0.5706	0.5706
Brugia malayi	putative neuropeptide receptor NPR1	0.01	0.5706	0.6027
Brugia malayi	RE15519p	0.01	0.5706	0.6027
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Schistosoma mansoni	adenoreceptor	0.01	0.5706	0.5128
Echinococcus granulosus	tachykinin peptides receptor 99D	0.01	0.5706	0.5715
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.01	0.5706	0.5128
Loa Loa (eye worm)	hypothetical protein	0.0028	0.1418	0.1497
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Loa Loa (eye worm)	hypothetical protein	0.01	0.5706	0.6027
Echinococcus multilocularis	rhodopsin orphan GPCR	0.01	0.5706	0.5706
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.01	0.5706	0.5128
Echinococcus multilocularis	serotonin receptor	0.01	0.5706	0.5706
Schistosoma mansoni	opsin-like receptor	0.01	0.5706	0.5128

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.16 uM	Inhibition of electric eel AChE using acetylcholine iodide as substrate after 10 mins by Ellman method	ChEMBL.	23376249
IC50 (binding)	= 17.02 uM	Inhibition of equine serum BChE using butyrylthiocholine iodide as substrate after 10 mins by Ellman method	ChEMBL.	23376249
Inhibition (binding)		Mixed-type inhibition of electric eel AChE using acetylcholine iodide as substrate at 0.12 to 0.17 uM by Lineweaver-Burk method	ChEMBL.	23376249

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: CHEMBL2337272

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1733991