TDR Targets

Basic information

Technical information

TDR Targets ID: 420009
Name: 2-amino-9-[(Z)-[2-fluoro-2-(hydroxymethyl)cyc lopropylidene]methyl]-3H-purin-6-one
MW: 251.217 | Formula: C10H10FN5O2
H donors: 3 H acceptors: 3 LogP: -1.69 Rotable bonds: 2
Rule of 5 violations (Lipinski): 1
SMILES: OCC1(F)C/C/1=C/n1cnc2c1nc(N)[nH]c2=O
InChi: 1S/C10H10FN5O2/c11-10(3-17)1-5(10)2-16-4-13-6-7(16)14-9(12)15-8(6)18/h2,4,17H,1,3H2,(H3,12,14,15,18)/b5-2-
InChiKey: ILGQQKONHVZYNI-DJWKRKHSSA-N

Network

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Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

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Clustering layers

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Synonyms

2-azanyl-9-[(Z)-[2-fluoro-2-(hydroxymethyl)cyclopropylidene]methyl]-3H-purin-6-one
2-amino-9-[(Z)-(2-fluoro-2-methylol-cyclopropylidene)methyl]-3H-purin-6-one

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
Schistosoma mansoni	growth hormone secretagogue receptor	0.0083	0.4698	0.3919
Schistosoma mansoni	tubulin subunit beta	0.0121	1	1
Leishmania major	alpha tubulin	0.0075	0.3565	0.2619
Onchocerca volvulus		0.0083	0.4698	0.5
Trypanosoma brucei	alpha tubulin	0.0075	0.3565	0.2619
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0083	0.4698	0.3919
Trypanosoma brucei	alpha tubulin	0.0075	0.3565	0.2619
Brugia malayi	GnHR receptor homolog	0.0083	0.4698	0.3919
Leishmania major	beta tubulin	0.0121	1	1
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Brugia malayi	tubulin alpha-2 chain	0.0075	0.3565	0.2619
Schistosoma mansoni	neuropeptide F-like receptor	0.0083	0.4698	0.3919
Trypanosoma brucei	beta tubulin	0.0121	1	1
Onchocerca volvulus		0.0083	0.4698	0.5
Echinococcus multilocularis	tubulin alpha 3 chain	0.0075	0.3565	0.2619
Schistosoma mansoni	tubulin subunit alpha	0.0075	0.3565	0.2619
Brugia malayi	neuropeptide F receptor	0.0083	0.4698	0.3919
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0121	1	1
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Schistosoma mansoni	neuropeptide receptor	0.0083	0.4698	0.3919
Trichomonas vaginalis	tubulin gamma chain, putative	0.0059	0.1282	0.1282
Echinococcus granulosus	tubulin subunit TubB	0.0075	0.3565	0.2619
Leishmania major	beta tubulin	0.0121	1	1
Echinococcus granulosus	tubulin alpha chain	0.0075	0.3565	0.2619
Schistosoma mansoni	tubulin subunit beta	0.0121	1	1
Echinococcus granulosus	Tubulin beta 2C chain	0.0121	1	1
Trypanosoma brucei	beta tubulin	0.0121	1	1
Schistosoma mansoni	neuropeptide receptor	0.0083	0.4698	0.3919
Onchocerca volvulus		0.0083	0.4698	0.5
Echinococcus multilocularis	G protein coupled receptor 139	0.0083	0.4698	0.3919
Leishmania major	beta tubulin	0.0121	1	1
Echinococcus multilocularis	neuropeptide receptor	0.0083	0.4698	0.3919
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0083	0.4698	0.3919
Trypanosoma brucei	alpha tubulin	0.0075	0.3565	0.2619
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0083	0.4698	0.3919
Echinococcus granulosus	rhodopsin orphan GPCR	0.0083	0.4698	0.3919
Entamoeba histolytica	tubulin family protein	0.0121	1	1
Loa Loa (eye worm)	TYRA-2 protein	0.0083	0.4698	0.4698
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0083	0.4698	0.3919
Echinococcus granulosus	tubulin alpha 3 chain	0.0075	0.3565	0.2619
Echinococcus granulosus	tubulin alpha chain	0.0075	0.3565	0.2619
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0083	0.4698	0.3919
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Schistosoma mansoni	alpha tubulin	0.0075	0.3565	0.2619
Schistosoma mansoni	opsin-like receptor	0.0083	0.4698	0.3919
Schistosoma mansoni	tubulin subunit alpha	0.0075	0.3565	0.2619
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0083	0.4698	0.3919
Onchocerca volvulus		0.0083	0.4698	0.5
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0083	0.4698	0.3919
Echinococcus granulosus	Tubulin alpha 1 chain	0.0075	0.3565	0.2619
Echinococcus multilocularis	g protein coupled receptor	0.0083	0.4698	0.3919
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Echinococcus granulosus	neuropeptide s receptor	0.0083	0.4698	0.3919
Leishmania major	beta tubulin	0.0121	1	1
Brugia malayi	AKH receptor	0.0083	0.4698	0.3919
Schistosoma mansoni	opsin-like receptor	0.0083	0.4698	0.3919
Entamoeba histolytica	tubulin alpha-1 chain	0.0075	0.3565	0.2619
Onchocerca volvulus		0.0083	0.4698	0.5
Echinococcus granulosus	tubulin beta 4A class IVa	0.0121	1	1
Brugia malayi	G protein-coupled receptor F59B2.13	0.0083	0.4698	0.3919
Loa Loa (eye worm)	hypothetical protein	0.0075	0.3565	0.3565
Echinococcus granulosus	allatostatin A receptor	0.0083	0.4698	0.3919
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Echinococcus granulosus	alpha tubulin	0.0075	0.3565	0.2619
Echinococcus multilocularis	g protein coupled receptor	0.0083	0.4698	0.3919
Loa Loa (eye worm)	BEN-1 protein	0.0121	1	1
Brugia malayi	Dopamine receptor protein 2	0.0083	0.4698	0.3919
Echinococcus multilocularis	neuropeptide Y receptor	0.0083	0.4698	0.3919
Brugia malayi	putative neuropeptide receptor NPR1	0.0083	0.4698	0.3919
Echinococcus multilocularis	tubulin alpha chain	0.0075	0.3565	0.2619
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0083	0.4698	0.3919
Trichomonas vaginalis	tubulin alpha chain, putative	0.0059	0.1282	0.1282
Onchocerca volvulus		0.0083	0.4698	0.5
Leishmania major	beta tubulin	0.0121	1	1
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0075	0.3565	0.3565
Echinococcus granulosus	beta tubulin	0.0121	1	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.0083	0.4698	0.3919
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0083	0.4698	0.3919
Brugia malayi	Dopamine receptor	0.0083	0.4698	0.3919
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0083	0.4698	0.3919
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Echinococcus granulosus	Tubulin alpha 1 chain	0.0075	0.3565	0.2619
Echinococcus granulosus	7TM GPCR rhodopsin	0.0083	0.4698	0.3919
Schistosoma mansoni	hypothetical protein	0.0083	0.4698	0.3919
Trichomonas vaginalis	tubulin gamma chain, putative	0.0121	1	1
Schistosoma mansoni	tubulin subunit alpha	0.0075	0.3565	0.2619
Brugia malayi	hypothetical protein	0.0083	0.4698	0.3919
Leishmania major	beta tubulin	0.0121	1	1
Echinococcus multilocularis	tubulin alpha 1C chain	0.0075	0.3565	0.2619
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0083	0.4698	0.3919
Echinococcus multilocularis	tubulin subunit TubB	0.0075	0.3565	0.2619
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0083	0.4698	0.4698
Echinococcus multilocularis	beta tubulin	0.0121	1	1
Brugia malayi	hypothetical protein	0.0083	0.4698	0.3919
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0075	0.3565	0.3565
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0083	0.4698	0.3919
Brugia malayi	sulfakinin receptor protein	0.0083	0.4698	0.3919
Trypanosoma cruzi	alpha tubulin, putative	0.0075	0.3565	0.2619
Plasmodium falciparum	alpha tubulin 2	0.0075	0.3565	0.2619
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0083	0.4698	0.3919
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0083	0.4698	0.4698
Schistosoma mansoni	neuropeptide receptor	0.0083	0.4698	0.3919
Schistosoma mansoni	alpha tubulin	0.0075	0.3565	0.2619
Echinococcus granulosus	beta tubulin	0.0121	1	1
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Echinococcus granulosus	tubulin subunit beta	0.0121	1	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0083	0.4698	0.3919
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0075	0.3565	0.2619
Toxoplasma gondii	beta tubulin	0.0121	1	1
Echinococcus granulosus	orexin receptor type 2	0.0083	0.4698	0.3919
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0083	0.4698	0.3919
Leishmania major	beta tubulin	0.0121	1	1
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Echinococcus granulosus	neuropeptide FF receptor 2	0.0083	0.4698	0.3919
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0083	0.4698	0.3919
Echinococcus multilocularis	tubulin alpha 3 chain	0.0075	0.3565	0.2619
Echinococcus multilocularis	fmrfamide receptor	0.0083	0.4698	0.3919
Onchocerca volvulus		0.0083	0.4698	0.5
Echinococcus granulosus	g protein coupled receptor	0.0083	0.4698	0.3919
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0083	0.4698	0.4698
Loa Loa (eye worm)	G-protein coupled receptor	0.0083	0.4698	0.4698
Echinococcus granulosus	rhodopsin orphan GPCR	0.0083	0.4698	0.3919
Loa Loa (eye worm)	tubulin beta chain	0.0121	1	1
Echinococcus multilocularis	sex peptide receptor	0.0083	0.4698	0.3919
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Schistosoma mansoni	tubulin subunit beta	0.0121	1	1
Loa Loa (eye worm)	neuropeptide F receptor	0.0083	0.4698	0.4698
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0083	0.4698	0.3919
Trichomonas vaginalis	tubulin beta chain, putative	0.0075	0.3565	0.3565
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Echinococcus multilocularis	hypothetical protein	0.0075	0.3565	0.2619
Echinococcus multilocularis	Tubulin beta 2C chain	0.0121	1	1
Giardia lamblia	Beta tubulin	0.0121	1	1
Onchocerca volvulus		0.0083	0.4698	0.5
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0083	0.4698	0.3919
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Toxoplasma gondii	alpha-tubulin I, putative	0.0075	0.3565	0.2619
Onchocerca volvulus	Dopamine\/Ecdysteroid receptor homolog	0.0083	0.4698	0.5
Loa Loa (eye worm)	tubulin beta-2A chain	0.0121	1	1
Schistosoma mansoni	biogenic amine receptor	0.0083	0.4698	0.3919
Leishmania major	beta tubulin	0.0121	1	1
Echinococcus multilocularis	allatostatin A receptor	0.0083	0.4698	0.3919
Leishmania major	beta tubulin	0.0121	1	1
Schistosoma mansoni	neuropeptide f receptor 76f	0.0083	0.4698	0.3919
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0121	1	1
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0083	0.4698	0.3919
Echinococcus multilocularis	neuropeptides capa receptor	0.0083	0.4698	0.3919
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0083	0.4698	0.3919
Plasmodium vivax	tubulin alpha chain, putative	0.0075	0.3565	0.2619
Echinococcus granulosus	7tm_1 domain containing protein	0.0083	0.4698	0.3919
Echinococcus granulosus	Tubulin beta 2C chain	0.0121	1	1
Echinococcus granulosus	sex peptide receptor	0.0083	0.4698	0.3919
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0083	0.4698	0.3919
Brugia malayi	neuropeptide F receptor	0.0083	0.4698	0.3919
Echinococcus granulosus	G protein coupled receptor 139	0.0083	0.4698	0.3919
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Onchocerca volvulus		0.0083	0.4698	0.5
Onchocerca volvulus		0.0083	0.4698	0.5
Brugia malayi	larval opioid receptor	0.0083	0.4698	0.3919
Schistosoma mansoni	tubulin subunit beta	0.0121	1	1
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0083	0.4698	0.3919
Plasmodium vivax	tubulin alpha chain, putative	0.0075	0.3565	0.2619
Loa Loa (eye worm)	alpha-tubulin	0.0075	0.3565	0.3565
Echinococcus granulosus	serotonin receptor	0.0083	0.4698	0.3919
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0083	0.4698	0.3919
Loa Loa (eye worm)	BEN-1 protein	0.0121	1	1
Loa Loa (eye worm)	melatonin receptor type 1A	0.0083	0.4698	0.4698
Echinococcus granulosus	neuropeptide receptor	0.0083	0.4698	0.3919
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0083	0.4698	0.3919
Brugia malayi	alpha-tubulin	0.0075	0.3565	0.2619
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0083	0.4698	0.3919
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0083	0.4698	0.3919
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0083	0.4698	0.3919
Schistosoma mansoni	amine GPCR	0.0083	0.4698	0.3919
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0083	0.4698	0.3919
Echinococcus granulosus	rhodopsin orphan GPCR	0.0083	0.4698	0.3919
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0083	0.4698	0.3919
Echinococcus granulosus	g protein coupled receptor	0.0083	0.4698	0.3919
Echinococcus granulosus	neuropeptides capa receptor	0.0083	0.4698	0.3919
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Schistosoma mansoni	hypothetical protein	0.0083	0.4698	0.3919
Echinococcus granulosus	neuropeptides capa receptor	0.0083	0.4698	0.3919
Giardia lamblia	Beta tubulin	0.0121	1	1
Loa Loa (eye worm)	tubulin alpha chain	0.0075	0.3565	0.3565
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0075	0.3565	0.2619
Schistosoma mansoni	amine GPCR	0.0083	0.4698	0.3919
Schistosoma mansoni	amine GPCR	0.0083	0.4698	0.3919
Brugia malayi	Serotonin receptor	0.0083	0.4698	0.3919
Echinococcus multilocularis	Tubulin beta 2C chain	0.0121	1	1
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0083	0.4698	0.3919
Toxoplasma gondii	beta-1 tubulin, putative	0.0121	1	1
Giardia lamblia	Alpha-tubulin	0.0075	0.3565	0.2619
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Brugia malayi	G protein-coupled receptor	0.0083	0.4698	0.3919
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Schistosoma mansoni	myosin xvIII	0.0083	0.4698	0.3919
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0083	0.4698	0.3919
Brugia malayi	putative neuropeptide receptor	0.0083	0.4698	0.3919
Brugia malayi	beta-tubulin, identical	0.0121	1	1
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Echinococcus granulosus	tm gpcr rhodopsin	0.0083	0.4698	0.3919
Brugia malayi	hypothetical protein	0.0083	0.4698	0.3919
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Brugia malayi	Tubulin alpha-2 chain	0.0075	0.3565	0.2619
Leishmania major	beta tubulin	0.0121	1	1
Echinococcus granulosus	tm gpcr rhodopsin	0.0083	0.4698	0.3919
Trichomonas vaginalis	tubulin beta chain, putative	0.0075	0.3565	0.3565
Loa Loa (eye worm)	tubulin beta-1 chain	0.0121	1	1
Echinococcus multilocularis	neuropeptide Y receptor	0.0083	0.4698	0.3919
Trichomonas vaginalis	tubulin alpha chain, putative	0.0121	1	1
Toxoplasma gondii	alpha tubulin TUBA1	0.0075	0.3565	0.2619
Leishmania major	alpha tubulin	0.0075	0.3565	0.2619
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0083	0.4698	0.3919
Brugia malayi	Tubulin alpha-2 chain	0.0075	0.3565	0.2619
Echinococcus granulosus	tubulin alpha chain	0.0075	0.3565	0.2619
Echinococcus granulosus	fmrfamide receptor	0.0083	0.4698	0.3919
Schistosoma mansoni	neuropeptide receptor	0.0083	0.4698	0.3919
Echinococcus multilocularis	peroxisome assembly protein 26	0.0075	0.3565	0.2619
Brugia malayi	hypothetical protein	0.0083	0.4698	0.3919
Loa Loa (eye worm)	alpha-tubulin	0.0075	0.3565	0.3565
Onchocerca volvulus		0.0083	0.4698	0.5
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0083	0.4698	0.3919
Trypanosoma brucei	alpha tubulin	0.0075	0.3565	0.2619
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0083	0.4698	0.3919
Loa Loa (eye worm)	beta-tubulin	0.0121	1	1
Echinococcus multilocularis	somatostatin receptor	0.0083	0.4698	0.3919
Trichomonas vaginalis	tubulin gamma chain, putative	0.0059	0.1282	0.1282
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0083	0.4698	0.3919
Echinococcus granulosus	tm gpcr rhodopsin	0.0083	0.4698	0.3919
Toxoplasma gondii	beta-tubulin, putative	0.0121	1	1
Brugia malayi	ORL1-like opioid receptor	0.0083	0.4698	0.3919
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Echinococcus granulosus	biogenic amine 5HT receptor	0.0083	0.4698	0.3919
Loa Loa (eye worm)	tubulin alpha chain	0.0075	0.3565	0.3565
Echinococcus granulosus	neuropeptide Y receptor	0.0083	0.4698	0.3919
Echinococcus granulosus	Tubulin beta 2C chain	0.0121	1	1
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0083	0.4698	0.3919
Echinococcus multilocularis	tubulin subunit beta	0.0121	1	1
Echinococcus multilocularis	tubulin alpha chain	0.0075	0.3565	0.2619
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0075	0.3565	0.3565
Trichomonas vaginalis	tubulin beta chain, putative	0.0075	0.3565	0.3565
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0083	0.4698	0.3919
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Leishmania major	beta tubulin	0.0121	1	1
Echinococcus granulosus	Tubulin beta 2C chain	0.0121	1	1
Schistosoma mansoni	biogenic amine receptor	0.0083	0.4698	0.3919
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0083	0.4698	0.3919
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0083	0.4698	0.3919
Leishmania major	beta tubulin	0.0121	1	1
Schistosoma mansoni	alpha tubulin	0.0075	0.3565	0.2619
Trichomonas vaginalis	tubulin beta chain, putative	0.0075	0.3565	0.3565
Leishmania major	beta tubulin	0.0121	1	1
Leishmania major	alpha tubulin	0.0075	0.3565	0.2619
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0083	0.4698	0.3919
Giardia lamblia	Beta tubulin	0.0121	1	1
Trichomonas vaginalis	tubulin beta chain, putative	0.0075	0.3565	0.3565
Schistosoma mansoni	hypothetical protein	0.0083	0.4698	0.3919
Schistosoma mansoni	hypothetical protein	0.0083	0.4698	0.3919
Echinococcus granulosus	neuropeptide receptor A26	0.0083	0.4698	0.3919
Brugia malayi	follicle stimulating hormone receptor	0.0083	0.4698	0.3919
Echinococcus multilocularis	g-protein coupled receptor	0.0083	0.4698	0.3919
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0083	0.4698	0.3919
Echinococcus granulosus	hypothetical protein	0.0083	0.4698	0.3919
Echinococcus granulosus	peroxisome assembly protein 26	0.0075	0.3565	0.2619
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.0083	0.4698	0.4698
Echinococcus multilocularis	tubulin alpha 1C chain	0.0075	0.3565	0.2619
Brugia malayi	hypothetical protein	0.0083	0.4698	0.3919
Brugia malayi	Serotonin receptor	0.0083	0.4698	0.3919
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Brugia malayi	hypothetical protein	0.0083	0.4698	0.3919
Echinococcus granulosus	rhodopsin orphan GPCR	0.0083	0.4698	0.3919
Echinococcus granulosus	Tubulin beta 2C chain	0.0121	1	1
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.0083	0.4698	0.4698
Trypanosoma brucei	beta tubulin	0.0121	1	1
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0083	0.4698	0.3919
Echinococcus granulosus	tubulin alpha 1C chain	0.0075	0.3565	0.2619
Schistosoma mansoni	amine GPCR	0.0083	0.4698	0.3919
Leishmania major	beta tubulin	0.0121	1	1
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0083	0.4698	0.3919
Leishmania major	beta tubulin	0.0121	1	1
Echinococcus granulosus	Tubulin alpha 1 chain	0.0075	0.3565	0.2619
Trichomonas vaginalis	tubulin beta chain, putative	0.0075	0.3565	0.3565
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0083	0.4698	0.3919
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Echinococcus multilocularis	tubulin, beta 4A class IVa	0.0121	1	1
Leishmania major	beta tubulin	0.0121	1	1
Schistosoma mansoni	neuropeptide F-like receptor	0.0083	0.4698	0.3919
Loa Loa (eye worm)	tubulin alpha-2 chain	0.0075	0.3565	0.3565
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0083	0.4698	0.3919
Schistosoma mansoni	histamine h1 receptor	0.0083	0.4698	0.3919
Echinococcus multilocularis	serotonin receptor	0.0083	0.4698	0.3919
Onchocerca volvulus		0.0083	0.4698	0.5
Onchocerca volvulus		0.0083	0.4698	0.5
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0083	0.4698	0.3919
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Trichomonas vaginalis	tubulin beta chain, putative	0.0121	1	1
Leishmania major	alpha tubulin	0.0075	0.3565	0.2619
Echinococcus multilocularis	serotonin receptor	0.0083	0.4698	0.3919
Echinococcus granulosus	rhodopsin orphan GPCR	0.0083	0.4698	0.3919
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0083	0.4698	0.3919
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0083	0.4698	0.3919
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0083	0.4698	0.3919
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Loa Loa (eye worm)	tubulin gamma chain	0.0059	0.1282	0.1282
Giardia lamblia	Alpha-tubulin	0.0075	0.3565	0.2619
Brugia malayi	hypothetical protein	0.0083	0.4698	0.3919
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0083	0.4698	0.3919
Leishmania major	alpha tubulin	0.0075	0.3565	0.2619
Echinococcus multilocularis	fmrfamide receptor	0.0083	0.4698	0.3919
Echinococcus multilocularis	tubulin beta 1 chain	0.0121	1	1
Trichomonas vaginalis	tubulin, putative	0.0121	1	1
Onchocerca volvulus		0.0083	0.4698	0.5
Trypanosoma cruzi	beta tubulin, putative	0.0121	1	1
Schistosoma mansoni	tubulin subunit beta	0.0121	1	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0083	0.4698	0.3919
Echinococcus multilocularis	neuropeptides capa receptor	0.0083	0.4698	0.3919
Onchocerca volvulus	Neuropeptide F receptor homolog	0.0083	0.4698	0.5
Leishmania major	beta tubulin	0.0121	1	1
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0083	0.4698	0.3919
Entamoeba histolytica	tubulin family protein	0.0121	1	1
Echinococcus multilocularis	neuropeptide s receptor	0.0083	0.4698	0.3919
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0083	0.4698	0.3919
Brugia malayi	Dopamine receptor protein 1	0.0083	0.4698	0.3919
Plasmodium falciparum	tubulin beta chain	0.0121	1	1
Echinococcus multilocularis	tubulin alpha chain	0.0075	0.3565	0.2619
Echinococcus granulosus	tubulin beta 1 chain	0.0121	1	1
Onchocerca volvulus		0.0083	0.4698	0.5
Echinococcus granulosus	biogenic amine 5HT receptor	0.0083	0.4698	0.3919
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0083	0.4698	0.3919
Echinococcus granulosus	g protein coupled receptor	0.0083	0.4698	0.3919
Loa Loa (eye worm)	tubulin beta-4 chain	0.0121	1	1
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0075	0.3565	0.2619
Leishmania major	alpha tubulin	0.0075	0.3565	0.2619
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0083	0.4698	0.3919
Schistosoma mansoni	opsin-like receptor	0.0083	0.4698	0.3919
Echinococcus granulosus	neuropeptide receptor	0.0083	0.4698	0.3919
Echinococcus multilocularis	g protein coupled receptor	0.0083	0.4698	0.3919
Plasmodium vivax	tubulin beta chain, putative	0.0121	1	1
Schistosoma mansoni	biogenic amine receptor	0.0083	0.4698	0.3919
Trypanosoma brucei	beta tubulin	0.0121	1	1
Leishmania major	alpha tubulin	0.0075	0.3565	0.2619
Brugia malayi	hypothetical protein	0.0083	0.4698	0.3919
Loa Loa (eye worm)	G-protein coupled receptor	0.0083	0.4698	0.4698
Brugia malayi	Tubulin alpha chain	0.0075	0.3565	0.2619
Echinococcus granulosus	rhodopsin orphan GPCR	0.0083	0.4698	0.3919
Brugia malayi	tubulin alpha chain - mouse	0.0075	0.3565	0.2619
Onchocerca volvulus		0.0083	0.4698	0.5
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0083	0.4698	0.3919
Brugia malayi	hypothetical protein	0.0083	0.4698	0.3919
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0083	0.4698	0.3919
Brugia malayi	Melatonin receptor type 1A	0.0083	0.4698	0.3919
Leishmania major	alpha tubulin	0.0075	0.3565	0.2619
Echinococcus multilocularis	Tubulin beta 2C chain	0.0121	1	1
Echinococcus multilocularis	dro:myosuppressin receptor	0.0083	0.4698	0.3919
Echinococcus multilocularis	neuropeptide receptor	0.0083	0.4698	0.3919
Leishmania major	alpha tubulin	0.0075	0.3565	0.2619
Onchocerca volvulus		0.0083	0.4698	0.5
Echinococcus multilocularis	Tubulin beta 2C chain	0.0121	1	1
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0083	0.4698	0.3919
Echinococcus granulosus	g-protein coupled receptor	0.0083	0.4698	0.3919
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0083	0.4698	0.3919
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0083	0.4698	0.3919
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Entamoeba histolytica	tubulin alpha chain, putative	0.0075	0.3565	0.2619
Echinococcus granulosus	tubulin alpha 3 chain	0.0075	0.3565	0.2619
Echinococcus multilocularis	tubulin alpha chain	0.0075	0.3565	0.2619
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Echinococcus multilocularis	Tubulin beta 2C chain	0.0121	1	1
Schistosoma mansoni	adenoreceptor	0.0083	0.4698	0.3919
Echinococcus multilocularis	beta tubulin	0.0121	1	1
Brugia malayi	RE15519p	0.0083	0.4698	0.3919
Leishmania major	alpha tubulin	0.0075	0.3565	0.2619
Echinococcus granulosus	tubulin alpha chain	0.0075	0.3565	0.2619
Brugia malayi	G-protein coupled receptor	0.0083	0.4698	0.3919
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Brugia malayi	G-protein coupled receptor	0.0083	0.4698	0.3919
Echinococcus granulosus	neuropeptide Y receptor	0.0083	0.4698	0.3919
Schistosoma mansoni	amine GPCR	0.0083	0.4698	0.3919
Leishmania major	beta tubulin	0.0121	1	1
Brugia malayi	hypothetical protein	0.0083	0.4698	0.3919
Loa Loa (eye worm)	neuropeptide F receptor	0.0083	0.4698	0.4698
Plasmodium falciparum	alpha tubulin 1	0.0075	0.3565	0.2619
Echinococcus multilocularis	tubulin alpha chain	0.0075	0.3565	0.2619
Leishmania major	alpha tubulin	0.0075	0.3565	0.2619
Echinococcus granulosus	dro:myosuppressin receptor	0.0083	0.4698	0.3919
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Echinococcus multilocularis	neuropeptide receptor A26	0.0083	0.4698	0.3919
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0083	0.4698	0.3919
Leishmania major	alpha tubulin	0.0075	0.3565	0.2619
Echinococcus granulosus	tubulin alpha 1C chain	0.0075	0.3565	0.2619
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0083	0.4698	0.3919
Echinococcus granulosus	somatostatin receptor	0.0083	0.4698	0.3919
Schistosoma mansoni	tubulin subunit beta	0.0121	1	1
Loa Loa (eye worm)	hypothetical protein	0.0083	0.4698	0.4698
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0083	0.4698	0.3919
Echinococcus granulosus	tubulin alpha chain	0.0075	0.3565	0.2619
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0083	0.4698	0.3919
Echinococcus multilocularis	orexin receptor type 2	0.0083	0.4698	0.3919

Activities

Activity type	Activity value	Assay description	Source	Reference
CC50 (ADMET)	> 100 uM	Cytotoxicity against HFF cells by visual cytotoxicty	ChEMBL.	15615545
CC50 (ADMET)	> 100 uM	Cytotoxicity against BSC1 cells	ChEMBL.	15615545
CC50 (functional)	> 100 uM	Cytotoxicity against CEM cells	ChEMBL.	15615545
CC50 (ADMET)	> 100 uM	Cytotoxicity against MT2 cells	ChEMBL.	15615545
CC50 (ADMET)	> 100 uM	Cytotoxicity against Vero cells	ChEMBL.	15615545
CC50 (ADMET)	> 100 uM	Cytotoxicity against HFF cells by visual cytotoxicty	ChEMBL.	15615545
CC50 (functional)	> 100 uM	Cytotoxicity against CEM cells	ChEMBL.	15615545
CC50 (ADMET)	> 100 uM	Cytotoxicity against MT2 cells	ChEMBL.	15615545
CC50 (ADMET)	> 199 uM	Cytotoxicity against Daudi cells	ChEMBL.	15615545
CC50 (ADMET)	> 199 uM	Cytotoxicity against human Daudi cells by DNA hybridization assay	ChEMBL.	18082410
CC50 (ADMET)	> 199 uM	Cytotoxicity against Daudi cells	ChEMBL.	15615545
CC50 (ADMET)	> 199 uM	Cytotoxicity against human Daudi cells by DNA hybridization assay	ChEMBL.	18082410
CC50 (ADMET)	> 398 uM	Cytotoxicity against HFF cells by neutral red uptake assay	ChEMBL.	15615545
CC50 (ADMET)	> 398 uM	Cytotoxicity against HFF cells by neutral red uptake assay	ChEMBL.	15615545
CC50 (ADMET)	> 400 uM	Cytotoxicity against HFF cells	ChEMBL.	15615545
CC50 (ADMET)	> 400 uM	Cytotoxicity against HFF cells	ChEMBL.	15615545
EC50 (functional)	= 4.8 uM	Inhibition of EBV replication in Daudi cells by VCA ELISA	ChEMBL.	15615545
EC50 (functional)	= 8 uM	Inhibition of EBV replication in Daudi cells by DNA hybridization assay	ChEMBL.	15615545
EC50 (functional)	= 8 uM	Antiviral activity against Epstein-Barr virus infected in human daudi cells by DNA hybridization assay	ChEMBL.	18082410
EC50 (functional)	> 20 uM	Inhibition of EBV replication in H1 cells by DNA hybridization assay	ChEMBL.	15615545
EC50 (functional)	> 20 uM	Inhibition of HBV replication in 2.2.15 cells by DNA hybridization assay	ChEMBL.	15615545
EC50 (functional)	> 50 uM	Inhibition of HSV1 in Vero cells by plaque reduction assay	ChEMBL.	15615545
EC50 (ADMET)	> 50 uM	Inhibition of HSV2 in Vero cells by plaque reduction assay	ChEMBL.	15615545
EC50 (functional)	> 79.6 uM	Inhibition of HCMV AD169 replication in HFF cells by CPE inhibition assay	ChEMBL.	15615545
EC50 (functional)	> 79.6 uM	Inhibition of VZV replication in HFF cells by CPE assay	ChEMBL.	15615545
EC50 (functional)	> 80 uM	Inhibition of HSV1 in HFF cells by CPE assay	ChEMBL.	15615545
EC50 (functional)	> 80 uM	Inhibition of HSV2 in HFF cells by CPE assay	ChEMBL.	15615545
EC50 (functional)	> 100 uM	Inhibition of HCMV Towne replication in HFF cells by plaque reduction assay	ChEMBL.	15615545
EC50 (functional)	> 100 uM	Inhibition of HSV1 replication in BSC1 cells by ELISA	ChEMBL.	15615545
EC50 (functional)	> 100 uM	Inhibition of HIV1 LAI replication in MT2 by CPE assay	ChEMBL.	15615545
Selectivity index (functional)	> 24.9	Selectivity index, ratio of EC50 for Epstein-Barr virus to CC50 for human Daudi cells	ChEMBL.	18082410

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: CHEMBL390155
PubChem: 11357168

Bibliographic References

2 literature references were collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 420009