TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 381.362 | Formula: C18H11N3O5S
H donors: 2 H acceptors: 5 LogP: 3.68 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: O=c1oc2ccccc2c(c1c1csc(n1)Nc1cccc(c1)[N+](=O)[O-])O
InChi: 1S/C18H11N3O5S/c22-16-12-6-1-2-7-14(12)26-17(23)15(16)13-9-27-18(20-13)19-10-4-3-5-11(8-10)21(24)25/h1-9,22H,(H,19,20)
InChiKey: XZAVSRMRDSNEFT-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

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Loa Loa (eye worm)	glycosyl hydrolase family 31 protein	0.0163	0.0409	0.0408
Brugia malayi	Dopamine receptor	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Onchocerca volvulus		0.0061	0.0101	0.0616
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0427	0.1211	0.121
Brugia malayi	Carboxylesterase family protein	0.0561	0.1619	0.1618
Echinococcus granulosus	lysine specific demethylase 5A	0.0034	0.0019	0.0019
Loa Loa (eye worm)	TYRA-2 protein	0.0061	0.0101	0.01
Echinococcus multilocularis	somatostatin receptor	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0061	0.0101	0.01
Schistosoma mansoni	jumonji domain containing protein	0.0074	0.0139	0.0138
Echinococcus granulosus	rhodopsin orphan GPCR	0.0061	0.0101	0.0101
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Schistosoma mansoni	biogenic amine receptor	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Schistosoma mansoni	sodium/chloride dependent transporter	0.0059	0.0094	0.0092
Schistosoma mansoni	alpha-glucosidase	0.014	0.034	0.0339
Brugia malayi	putative neuropeptide receptor NPR1	0.0061	0.0101	0.01
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0061	0.0101	0.0101
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0061	0.0101	0.01
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0061	0.0101	0.01
Echinococcus granulosus	7tm_1 domain containing protein	0.0061	0.0101	0.0101
Echinococcus multilocularis	acetylcholinesterase	0.3323	1	1
Brugia malayi	WGR domain containing protein	0.0079	0.0156	0.0155
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0061	0.0101	0.01
Brugia malayi	neuropeptide F receptor	0.0061	0.0101	0.01
Echinococcus granulosus	fmrfamide receptor	0.0061	0.0101	0.0101
Echinococcus multilocularis	allatostatin A receptor	0.0061	0.0101	0.01
Brugia malayi	AKH receptor	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Onchocerca volvulus	Neuropeptide F receptor homolog	0.0061	0.0101	0.0616
Brugia malayi	Sodium:neurotransmitter symporter family protein	0.0059	0.0094	0.0092
Loa Loa (eye worm)	hypothetical protein	0.0049	0.0063	0.0061
Schistosoma mansoni	biogenic amine (5HT) receptor	0.018	0.046	0.0459
Schistosoma mansoni	amine GPCR	0.0061	0.0101	0.01
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0561	0.1619	0.5
Brugia malayi	Glycosyl hydrolases family 31 protein	0.0163	0.0409	0.0408
Echinococcus granulosus	poly adp ribose polymerase 2	0.0079	0.0156	0.0156
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0029	0.0003	0.0002
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0061	0.0101	0.01
Schistosoma mansoni	amine GPCR	0.0061	0.0101	0.01
Brugia malayi	hypothetical protein	0.0061	0.0101	0.01
Brugia malayi	hypothetical protein	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0561	0.1619	0.1618
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.3323	1	1
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Brugia malayi	larval opioid receptor	0.0061	0.0101	0.01
Echinococcus multilocularis	BC026374 protein (S09 family)	0.0561	0.1619	0.1618
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Echinococcus multilocularis	fmrfamide receptor	0.0061	0.0101	0.01
Echinococcus granulosus	hypothetical protein	0.0732	0.2137	0.2137
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0061	0.0101	0.0101
Echinococcus granulosus	biogenic amine 5HT receptor	0.018	0.046	0.046
Trichomonas vaginalis	spcc417.12 protein, putative	0.0561	0.1619	1
Echinococcus granulosus	tm gpcr rhodopsin	0.0061	0.0101	0.0101
Echinococcus granulosus	neuropeptide Y receptor	0.0061	0.0101	0.0101
Brugia malayi	jmjC domain containing protein	0.0034	0.0019	0.0018
Echinococcus granulosus	g protein coupled receptor	0.0061	0.0101	0.0101
Brugia malayi	Carboxylesterase family protein	0.0561	0.1619	0.1618
Echinococcus granulosus	histone lysine methyltransferase setb	0.0029	0.0003	0.0003
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0061	0.0101	0.01
Echinococcus multilocularis	serotonin transporter	0.0059	0.0094	0.0092
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0061	0.0101	0.01
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0061	0.0101	0.01
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0061	0.0101	0.01
Echinococcus multilocularis	g-protein coupled receptor	0.0061	0.0101	0.01
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0061	0.0101	0.01
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0061	0.0101	0.0101
Echinococcus multilocularis	neuropeptide Y receptor	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Echinococcus multilocularis	G protein coupled receptor 139	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.018	0.046	0.0459
Loa Loa (eye worm)	glycosyl hydrolase family 31 protein	0.0036	0.0025	0.0024
Brugia malayi	Carboxylesterase family protein	0.0561	0.1619	0.1618
Echinococcus granulosus	WGR domain containing protein	0.0045	0.0051	0.0051
Mycobacterium tuberculosis	Carboxylesterase LipT	0.0561	0.1619	0.5
Schistosoma mansoni	amine GPCR	0.0061	0.0101	0.01
Echinococcus granulosus	lysosomal alpha glucosidase	0.0163	0.0409	0.0409
Echinococcus granulosus	serotonin transporter	0.0059	0.0094	0.0094
Echinococcus granulosus	serotonin receptor	0.0061	0.0101	0.0101
Echinococcus granulosus	peregrin	0.0028	0.0001	0.0001
Echinococcus granulosus	jumonji domain containing protein	0.0039	0.0035	0.0035
Echinococcus granulosus	poly (ADP ribose) polymerase	0.0045	0.0051	0.0051
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0427	0.1211	0.121
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0061	0.0101	0.01
Brugia malayi	Carboxylesterase family protein	0.3323	1	1
Echinococcus multilocularis	Transcription factor, JmjC domain containing protein	0.0093	0.0197	0.0196
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Schistosoma mansoni	neuropeptide receptor	0.0061	0.0101	0.01
Brugia malayi	hypothetical protein	0.0561	0.1619	0.1618
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0029	0.0003	0.0002
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0061	0.0101	0.01
Schistosoma mansoni	hypothetical protein	0.0061	0.0101	0.01
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0061	0.0101	0.0101
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Onchocerca volvulus		0.0561	0.1619	1
Loa Loa (eye worm)	norepinephrine transporter	0.0059	0.0094	0.0092
Schistosoma mansoni	amine GPCR	0.0061	0.0101	0.01
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0061	0.0101	0.01
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0061	0.0101	0.01
Loa Loa (eye worm)	carboxylesterase	0.0561	0.1619	0.1618
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0061	0.0101	0.01
Echinococcus granulosus	rhodopsin orphan GPCR	0.0061	0.0101	0.0101
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0061	0.0101	0.01
Echinococcus granulosus	G protein coupled receptor 139	0.0061	0.0101	0.0101
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0061	0.0101	0.01
Echinococcus multilocularis	lysine specific demethylase 5A	0.0034	0.0019	0.0018
Schistosoma mansoni	growth hormone secretagogue receptor	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0059	0.0094	0.0092
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0061	0.0101	0.0101
Echinococcus multilocularis	orexin receptor type 2	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Schistosoma mansoni	hypothetical protein	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0034	0.0019	0.0018
Loa Loa (eye worm)	neuropeptide F receptor	0.0061	0.0101	0.01
Trichomonas vaginalis	set domain proteins, putative	0.023	0.0614	0.3696
Echinococcus multilocularis	neuropeptides capa receptor	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.011	0.0249	0.0247
Echinococcus granulosus	somatostatin receptor	0.0061	0.0101	0.0101
Echinococcus granulosus	geminin	0.0169	0.0429	0.0429
Schistosoma mansoni	histamine h1 receptor	0.0061	0.0101	0.01
Brugia malayi	Dopamine receptor protein 2	0.0061	0.0101	0.01
Schistosoma mansoni	neuropeptide F-like receptor	0.0061	0.0101	0.01
Trypanosoma cruzi	poly(ADP-ribose) polymerase, putative	0.0079	0.0156	1
Loa Loa (eye worm)	hypothetical protein	0.0059	0.0094	0.0092
Schistosoma mansoni	opsin-like receptor	0.0061	0.0101	0.01
Echinococcus granulosus	orexin receptor type 2	0.0061	0.0101	0.0101
Onchocerca volvulus		0.0561	0.1619	1
Brugia malayi	Serotonin receptor	0.0061	0.0101	0.01
Onchocerca volvulus		0.0061	0.0101	0.0616
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0561	0.1619	0.1618
Brugia malayi	hypothetical protein	0.0061	0.0101	0.01
Treponema pallidum	sodium- and chloride- dependent transporter	0.0059	0.0094	0.5
Echinococcus granulosus	biogenic amine 5HT receptor	0.0427	0.1211	0.1211
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Echinococcus multilocularis	serotonin receptor	0.018	0.046	0.0459
Echinococcus granulosus	allatostatin A receptor	0.0061	0.0101	0.0101
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0061	0.0101	0.01
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0061	0.0101	0.01
Echinococcus multilocularis	g protein coupled receptor	0.0061	0.0101	0.01
Echinococcus multilocularis	g protein coupled receptor	0.0061	0.0101	0.01
Echinococcus granulosus	family S9 non peptidase ue S09 family	0.0561	0.1619	0.1619
Echinococcus granulosus	acetylcholinesterase	0.3323	1	1
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0561	0.1619	0.1618
Loa Loa (eye worm)	acetylcholinesterase 1	0.3323	1	1
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0029	0.0003	0.0002
Schistosoma mansoni	adenoreceptor	0.0061	0.0101	0.01
Echinococcus granulosus	rhodopsin orphan GPCR	0.0061	0.0101	0.0101
Brugia malayi	hypothetical protein	0.0061	0.0101	0.01
Echinococcus granulosus	expressed protein	0.0378	0.1061	0.1061
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0061	0.0101	0.01
Echinococcus granulosus	rhodopsin orphan GPCR	0.0061	0.0101	0.0101
Schistosoma mansoni	hypothetical protein	0.0061	0.0101	0.01
Brugia malayi	putative neuropeptide receptor	0.0061	0.0101	0.01
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0061	0.0101	0.01
Onchocerca volvulus		0.0061	0.0101	0.0616
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Schistosoma mansoni	norepinephrine/norepinephrine transporter	0.0059	0.0094	0.0092
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0061	0.0101	0.01
Mycobacterium ulcerans	carboxylesterase, LipT	0.0561	0.1619	0.5
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0561	0.1619	0.1618
Loa Loa (eye worm)	hypothetical protein	0.0059	0.0094	0.0092
Echinococcus granulosus	tm gpcr rhodopsin	0.0061	0.0101	0.0101
Schistosoma mansoni	neuropeptide F-like receptor	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Echinococcus granulosus	tm gpcr rhodopsin	0.0061	0.0101	0.0101
Onchocerca volvulus		0.0059	0.0094	0.0571
Echinococcus multilocularis	sex peptide receptor	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0561	0.1619	0.1618
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0061	0.0101	0.01
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0061	0.0101	0.01
Loa Loa (eye worm)	jmjC domain-containing protein	0.0059	0.0093	0.0092
Schistosoma mansoni	alpha-glucosidase	0.014	0.034	0.0339
Schistosoma mansoni	alpha glucosidase	0.0036	0.0025	0.0024
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.0061	0.0101	0.01
Schistosoma mansoni	hypothetical protein	0.0061	0.0101	0.01
Brugia malayi	Carboxylesterase family protein	0.0561	0.1619	0.1618
Schistosoma mansoni	myosin xvIII	0.0061	0.0101	0.01
Trichomonas vaginalis	carboxylesterase domain containing protein, putative	0.0561	0.1619	1
Schistosoma mansoni	poly [ADP-ribose] polymerase	0.0079	0.0156	0.0155
Echinococcus granulosus	rhodopsin orphan GPCR	0.0061	0.0101	0.0101
Schistosoma mansoni	poly [ADP-ribose] polymerase	0.0069	0.0123	0.0122
Schistosoma mansoni	poly [ADP-ribose] polymerase	0.0144	0.0353	0.0352
Echinococcus granulosus	neuropeptide receptor	0.0061	0.0101	0.0101
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0061	0.0101	0.01
Schistosoma mansoni	neuropeptide receptor	0.0061	0.0101	0.01
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0061	0.0101	0.01
Onchocerca volvulus		0.0061	0.0101	0.0616
Echinococcus multilocularis	lysosomal alpha glucosidase	0.0163	0.0409	0.0408
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0061	0.0101	0.01
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0034	0.0019	0.0018
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0061	0.0101	0.01
Echinococcus multilocularis	poly (ADP ribose) polymerase	0.0033	0.0016	0.0014
Onchocerca volvulus		0.0061	0.0101	0.0616
Brugia malayi	Melatonin receptor type 1A	0.0061	0.0101	0.01
Onchocerca volvulus		0.0061	0.0101	0.0616
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0202	0.0529	0.0528
Echinococcus granulosus	g protein coupled receptor	0.0061	0.0101	0.0101
Schistosoma mansoni	gliotactin	0.0561	0.1619	0.1618
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0029	0.0003	0.0056
Loa Loa (eye worm)	poly(ADP-ribose) polymerase	0.0057	0.0088	0.0087
Echinococcus granulosus	neuropeptides capa receptor	0.0061	0.0101	0.0101
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0561	0.1619	0.1618
Echinococcus granulosus	neuropeptide receptor A26	0.0061	0.0101	0.0101
Brugia malayi	G protein-coupled receptor	0.0061	0.0101	0.01
Brugia malayi	G protein-coupled receptor F59B2.13	0.0061	0.0101	0.01
Brugia malayi	WGR domain containing protein	0.0144	0.0353	0.0352
Brugia malayi	follicle stimulating hormone receptor	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.018	0.046	0.0459
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0561	0.1619	0.5
Toxoplasma gondii	glycosyl hydrolase, family 31 protein	0.0036	0.0025	0.0639
Brugia malayi	neuropeptide F receptor	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0079	0.0156	0.0155
Onchocerca volvulus		0.0094	0.0201	0.1234
Loa Loa (eye worm)	jmjC domain-containing protein	0.0034	0.0019	0.0018
Echinococcus granulosus	g protein coupled receptor	0.0061	0.0101	0.0101
Schistosoma mansoni	opsin-like receptor	0.0061	0.0101	0.01
Echinococcus multilocularis	acetylcholinesterase	0.3323	1	1
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0061	0.0101	0.01
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0061	0.0101	0.01
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0061	0.0101	0.01
Echinococcus multilocularis	poly (ADP ribose) polymerase 1	0.0144	0.0353	0.0352
Echinococcus multilocularis	neuropeptides capa receptor	0.0061	0.0101	0.01
Echinococcus multilocularis	dro:myosuppressin receptor	0.0061	0.0101	0.01
Onchocerca volvulus		0.0029	0.0003	0.0013
Echinococcus multilocularis	expressed protein	0.0378	0.1061	0.106
Echinococcus granulosus	carboxylesterase 5A	0.3323	1	1
Schistosoma mansoni	hypothetical protein	0.0169	0.0429	0.0428
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0061	0.0101	0.01
Onchocerca volvulus		0.0061	0.0101	0.0616
Echinococcus granulosus	neuropeptides capa receptor	0.0061	0.0101	0.0101
Loa Loa (eye worm)	serotonin transporter b	0.0059	0.0094	0.0092
Brugia malayi	G-protein coupled receptor	0.0061	0.0101	0.01
Echinococcus multilocularis	family S9 non peptidase ue (S09 family)	0.0561	0.1619	0.1618
Loa Loa (eye worm)	solute carrier family 6 member 4	0.0059	0.0094	0.0092
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0561	0.1619	0.1618
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0061	0.0101	0.01
Echinococcus multilocularis	g protein coupled receptor	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Onchocerca volvulus		0.0561	0.1619	1
Brugia malayi	hypothetical protein	0.0061	0.0101	0.01
Echinococcus granulosus	sex peptide receptor	0.0061	0.0101	0.0101
Schistosoma mansoni	opsin-like receptor	0.0061	0.0101	0.01
Brugia malayi	Glycosyl hydrolases family 31 protein	0.0036	0.0025	0.0024
Echinococcus multilocularis	neutral alpha glucosidase AB	0.0036	0.0025	0.0024
Echinococcus multilocularis	neuropeptide Y receptor	0.0061	0.0101	0.01
Loa Loa (eye worm)	melatonin receptor type 1A	0.0061	0.0101	0.01
Onchocerca volvulus		0.0061	0.0101	0.0616
Trypanosoma cruzi	poly(ADP-ribose) polymerase, putative	0.0079	0.0156	1
Echinococcus multilocularis	para nitrobenzyl esterase	0.0561	0.1619	0.1618
Echinococcus multilocularis	neuropeptide receptor	0.0061	0.0101	0.01
Onchocerca volvulus		0.0061	0.0101	0.0616
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0003	0.0002
Brugia malayi	sulfakinin receptor protein	0.0061	0.0101	0.01
Echinococcus granulosus	Transcription factor JmjC domain containing protein	0.0093	0.0197	0.0197
Brugia malayi	Serotonin receptor	0.0508	0.1458	0.1457
Brugia malayi	G-protein coupled receptor	0.0061	0.0101	0.01
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0029	0.0003	0.0002
Echinococcus multilocularis	carboxylesterase 5A	0.3323	1	1
Loa Loa (eye worm)	hypothetical protein	0.0561	0.1619	0.1618
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0061	0.0101	0.01
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0061	0.0101	0.01
Brugia malayi	GnHR receptor homolog	0.0061	0.0101	0.01
Onchocerca volvulus		0.0061	0.0101	0.0616
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0061	0.0101	0.01
Echinococcus granulosus	para nitrobenzyl esterase	0.0561	0.1619	0.1619
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Brugia malayi	hypothetical protein	0.0061	0.0101	0.01
Echinococcus multilocularis	fmrfamide receptor	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0061	0.0101	0.01
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0061	0.0101	0.01
Brugia malayi	hypothetical protein	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Echinococcus granulosus	neutral alpha glucosidase AB	0.0036	0.0025	0.0025
Schistosoma mansoni	neuropeptide receptor	0.0061	0.0101	0.01
Echinococcus granulosus	acetylcholinesterase	0.3323	1	1
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Echinococcus multilocularis	neuropeptide s receptor	0.0061	0.0101	0.01
Schistosoma mansoni	neuropeptide receptor	0.0061	0.0101	0.01
Echinococcus granulosus	neuropeptide receptor	0.0061	0.0101	0.0101
Echinococcus granulosus	neuropeptide Y receptor	0.0061	0.0101	0.0101
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0061	0.0101	0.01
Schistosoma mansoni	BC026374 protein (S09 family)	0.0561	0.1619	0.1618
Schistosoma mansoni	neuroligin 3 (S09 family)	0.0561	0.1619	0.1618
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Schistosoma mansoni	acetylcholinesterase	0.0561	0.1619	0.1618
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0061	0.0101	0.01
Echinococcus granulosus	neuropeptide FF receptor 2	0.0061	0.0101	0.0101
Brugia malayi	Pre-SET motif family protein	0.0029	0.0003	0.0002
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0061	0.0101	0.01
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0061	0.0101	0.01
Echinococcus granulosus	g-protein coupled receptor	0.0061	0.0101	0.0101
Brugia malayi	hypothetical protein	0.0061	0.0101	0.01
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0061	0.0101	0.0101
Onchocerca volvulus		0.0061	0.0101	0.0616
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Schistosoma mansoni	hypothetical protein	0.0169	0.0429	0.0428
Plasmodium vivax	SET domain protein, putative	0.0029	0.0003	1
Brugia malayi	Pre-SET motif family protein	0.0202	0.0529	0.0528
Leishmania major	alpha glucosidase II subunit, putative	0.0036	0.0025	0.5
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0061	0.0101	0.01
Brugia malayi	hypothetical protein	0.0061	0.0101	0.01
Schistosoma mansoni	neuropeptide f receptor 76f	0.0061	0.0101	0.01
Echinococcus granulosus	dro:myosuppressin receptor	0.0061	0.0101	0.0101
Loa Loa (eye worm)	hypothetical protein	0.0561	0.1619	0.1618
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0029	0.0003	0.0002
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0061	0.0101	0.01
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0061	0.0101	0.01
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Onchocerca volvulus		0.0061	0.0101	0.0616
Onchocerca volvulus		0.0561	0.1619	1
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.0061	0.0101	0.01
Onchocerca volvulus		0.0061	0.0101	0.0616
Plasmodium falciparum	phd finger protein, putative	0.0028	0.0001	0.5
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0061	0.0101	0.01
Onchocerca volvulus		0.0061	0.0101	0.0616
Onchocerca volvulus		0.0061	0.0101	0.0616
Echinococcus multilocularis	poly (adp ribose) polymerase 2	0.0079	0.0156	0.0155
Echinococcus granulosus	PHD finger protein rhinoceros	0.0028	0.0001	0.0001
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.3323	1	1
Onchocerca volvulus	Dopamine\/Ecdysteroid receptor homolog	0.0061	0.0101	0.0616
Echinococcus granulosus	rhodopsin orphan GPCR	0.0061	0.0101	0.0101
Onchocerca volvulus		0.0061	0.0101	0.0616
Echinococcus multilocularis	jumonji domain containing protein	0.0039	0.0035	0.0034
Onchocerca volvulus		0.0061	0.0101	0.0616
Echinococcus multilocularis	serotonin receptor	0.018	0.046	0.0459
Schistosoma mansoni	biogenic amine receptor	0.0061	0.0101	0.01
Schistosoma mansoni	biogenic amine receptor	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Loa Loa (eye worm)	G-protein coupled receptor	0.0061	0.0101	0.01
Echinococcus multilocularis	neuroligin	0.0561	0.1619	0.1618
Onchocerca volvulus		0.0561	0.1619	1
Echinococcus granulosus	neuropeptide s receptor	0.0061	0.0101	0.0101
Brugia malayi	hypothetical protein	0.0061	0.0101	0.01
Echinococcus granulosus	7TM GPCR rhodopsin	0.0061	0.0101	0.0101
Toxoplasma gondii	poly(ADP-ribose) polymerase catalytic domain-containing protein	0.015	0.037	1
Entamoeba histolytica	poly(ADP-ribose) polymerase, putative	0.0144	0.0353	1
Echinococcus granulosus	poly ADP ribose polymerase 1	0.0144	0.0353	0.0353
Onchocerca volvulus		0.023	0.0614	0.3788
Brugia malayi	ORL1-like opioid receptor	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Schistosoma mansoni	amine GPCR	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Echinococcus granulosus	BC026374 protein S09 family	0.0561	0.1619	0.1619
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0061	0.0101	0.0101
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0061	0.0101	0.0101
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0061	0.0101	0.0101
Brugia malayi	jmjC domain containing protein	0.0093	0.0197	0.0196
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Trypanosoma brucei	poly(adp-ribose) polymerase	0.0079	0.0156	1
Brugia malayi	Dopamine receptor protein 1	0.0061	0.0101	0.01
Brugia malayi	RE15519p	0.0061	0.0101	0.01
Echinococcus multilocularis	neuropeptide receptor	0.0061	0.0101	0.01
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0061	0.0101	0.01
Giardia lamblia	PHD finger protein 15	0.0028	0.0001	0.5
Loa Loa (eye worm)	carboxylesterase	0.0561	0.1619	0.1618
Loa Loa (eye worm)	neuropeptide F receptor	0.0061	0.0101	0.01
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.3323	1	1
Echinococcus granulosus	neuroligin	0.0561	0.1619	0.1619
Loa Loa (eye worm)	G-protein coupled receptor	0.0061	0.0101	0.01
Echinococcus multilocularis	lysosomal alpha glucosidase	0.0163	0.0409	0.0408
Echinococcus multilocularis	neuropeptide receptor A26	0.0061	0.0101	0.01
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0061	0.0101	0.01
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0029	0.0003	0.0002
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Echinococcus granulosus	rhodopsin orphan GPCR	0.0061	0.0101	0.0101
Echinococcus multilocularis	conserved hypothetical protein	0.0671	0.1951	0.195
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0561	0.1619	0.1618
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0101	0.01
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0061	0.0101	0.01
Loa Loa (eye worm)	carboxylesterase	0.3323	1	1
Echinococcus multilocularis	geminin	0.0169	0.0429	0.0428

Activities

Activity type	Activity value	Assay description	Source	Reference
Ki (binding)	= 79.6 uM	Inhibition of VKORC1	ChEMBL.	22633008
PT (functional)	= 24.4 s	Anticoagulant activity in human plasma assessed as prothrombin time at 1 mg/ml	ChEMBL.	22633008

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: CHEMBL2048096

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1655308