TDR Targets

Basic information

Technical information

TDR Targets ID: 335397
Name: hydroxy-[1-hydroxy-2-(3-methylpyridin-1-ium-1 -yl)-1-phosphonoethyl]phosphinate
MW: 297.139 | Formula: C8H13NO7P2
H donors: 4 H acceptors: 7 LogP: -3.06 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: Cc1ccc[n+](c1)CC(P(=O)(O)O)(P(=O)(O)[O-])O
InChi: 1S/C8H13NO7P2/c1-7-3-2-4-9(5-7)6-8(10,17(11,12)13)18(14,15)16/h2-5,10H,6H2,1H3,(H3-,11,12,13,14,15,16)
InChiKey: WNMNDCTVXVBAFC-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

hydroxy-[1-hydroxy-2-(3-methylpyridin-1-ium-1-yl)-1-phosphono-ethyl]phosphinate
hydroxy-[1-hydroxy-2-(3-methyl-1-pyridin-1-iumyl)-1-phosphonoethyl]phosphinate

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Leishmania donovani	farnesyl pyrophosphate synthase	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Leishmania major	farnesyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Leishmania donovani	farnesyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Candida albicans	similar to S. cerevisiae ERG20 (YJL167W) farnesyl diphosphate synthetase (FPP synthetase)	Get druggable targets OG5_127590	All targets in OG5_127590
Cryptosporidium parvum	putative farnesyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Mycobacterium ulcerans	geranylgeranyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Neospora caninum	hypothetical protein	Get druggable targets OG5_127590	All targets in OG5_127590
Echinococcus granulosus	farnesyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Loa Loa (eye worm)	polyprenyl synthetase	Get druggable targets OG5_127590	All targets in OG5_127590
Trichomonas vaginalis	geranylgeranyl diphosphate synthase, putative	Get druggable targets OG5_127590	All targets in OG5_127590
Mycobacterium ulcerans	geranylgeranyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Toxoplasma gondii	polyprenyl synthetase superfamily protein	Get druggable targets OG5_127590	All targets in OG5_127590
Plasmodium berghei	geranylgeranyl pyrophosphate synthase, putative	Get druggable targets OG5_127590	All targets in OG5_127590
Schistosoma japonicum	ko:K00787 dimethylallyltranstransferase [EC2.5.1.1], putative	Get druggable targets OG5_127590	All targets in OG5_127590
Echinococcus multilocularis	farnesyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Plasmodium yoelii	farnesyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Plasmodium knowlesi	geranylgeranyl pyrophosphate synthase, putative	Get druggable targets OG5_127590	All targets in OG5_127590
Babesia bovis	farnesyl pyrophosphate synthetase, putative	Get druggable targets OG5_127590	All targets in OG5_127590
Trichomonas vaginalis	geranylgeranyl pyrophosphate synthase, putative	Get druggable targets OG5_127590	All targets in OG5_127590
Plasmodium vivax	geranylgeranyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Trypanosoma cruzi	farnesyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Giardia lamblia	Farnesyl diphosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Trypanosoma congolense	farnesyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Trypanosoma cruzi	farnesyl pyrophosphate synthase, putative	Get druggable targets OG5_127590	All targets in OG5_127590
Leishmania mexicana	farnesyl pyrophosphate synthase, putative	Get druggable targets OG5_127590	All targets in OG5_127590
Candida albicans	similar to S. cerevisiae ERG20 (YJL167W) farnesyl diphosphate synthetase (FPP synthetase)	Get druggable targets OG5_127590	All targets in OG5_127590
Schistosoma mansoni	farnesyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Trypanosoma brucei	farnesyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Brugia malayi	Polyprenyl synthetase family protein	Get druggable targets OG5_127590	All targets in OG5_127590
Theileria parva	farnesyl pyrophosphate synthetase, putative	Get druggable targets OG5_127590	All targets in OG5_127590
Mycobacterium tuberculosis	Probable geranylgeranyl pyrophosphate synthetase IdsA2 (ggppsase) (GGPP synthetase) (geranylgeranyl diphosphate synthase)	Get druggable targets OG5_127590	All targets in OG5_127590
Trypanosoma brucei gambiense	farnesyl pyrophosphate synthase, putative	Get druggable targets OG5_127590	All targets in OG5_127590
Leishmania infantum	farnesyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Trichomonas vaginalis	geranylgeranyl pyrophosphate synthase, putative	Get druggable targets OG5_127590	All targets in OG5_127590
Plasmodium falciparum	geranylgeranyl pyrophosphate synthase, putative	Get druggable targets OG5_127590	All targets in OG5_127590
Leishmania braziliensis	farnesyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Cryptosporidium hominis	farnesyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590

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
Echinococcus granulosus	neuropeptide receptor A26	0.0038	0.0455	0.0455
Echinococcus granulosus	voltage dependent calcium channel type d subunit\|voltage dependent calcium channel\|voltage dependent L type calcium channel subu	0.0076	0.2893	0.2893
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Trypanosoma cruzi	farnesyl pyrophosphate synthase, putative	0.0124	0.6005	1
Schistosoma mansoni	high voltage-activated calcium channel Cav2A	0.0076	0.2893	0.2893
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0038	0.0455	0.0455
Brugia malayi	ORL1-like opioid receptor	0.0038	0.0455	0.0455
Echinococcus granulosus	sex peptide receptor	0.0038	0.0455	0.0455
Loa Loa (eye worm)	calcium channel	0.0076	0.2893	0.2893
Schistosoma mansoni	amine GPCR	0.0038	0.0455	0.0455
Brugia malayi	G protein-coupled receptor F59B2.13	0.0038	0.0455	0.0455
Echinococcus granulosus	g protein coupled receptor	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Schistosoma mansoni	amine GPCR	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Brugia malayi	RE15519p	0.0038	0.0455	0.0455
Echinococcus granulosus	rhodopsin orphan GPCR	0.0038	0.0455	0.0455
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0038	0.0455	0.0455
Schistosoma mansoni	biogenic amine receptor	0.0038	0.0455	0.0455
Brugia malayi	putative neuropeptide receptor	0.0038	0.0455	0.0455
Schistosoma mansoni	growth hormone secretagogue receptor	0.0038	0.0455	0.0455
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0038	0.0455	0.0455
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0038	0.0455	0.0455
Schistosoma mansoni	biogenic amine receptor	0.0038	0.0455	0.0455
Schistosoma mansoni	sodium/chloride dependent transporter	0.0185	1	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0038	0.0455	0.0455
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0038	0.0455	0.0455
Brugia malayi	hypothetical protein	0.0038	0.0455	0.0455
Echinococcus multilocularis	voltage dependent L type calcium channel subunit	0.0076	0.2893	0.2893
Echinococcus granulosus	g protein coupled receptor	0.0038	0.0455	0.0455
Schistosoma mansoni	opsin-like receptor	0.0038	0.0455	0.0455
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0038	0.0455	0.0455
Echinococcus granulosus	dro:myosuppressin receptor	0.0038	0.0455	0.0455
Schistosoma mansoni	amine GPCR	0.0038	0.0455	0.0455
Echinococcus multilocularis	neuropeptide receptor	0.0038	0.0455	0.0455
Onchocerca volvulus	Dopamine\/Ecdysteroid receptor homolog	0.0038	0.0455	0.0455
Onchocerca volvulus		0.0038	0.0455	0.0455
Plasmodium vivax	geranylgeranyl pyrophosphate synthase	0.0124	0.6005	1
Schistosoma mansoni	neuropeptide F-like receptor	0.0038	0.0455	0.0455
Brugia malayi	hypothetical protein	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.0038	0.0455	0.0455
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0038	0.0455	0.0455
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0038	0.0455	0.0455
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0038	0.0455	0.0455
Echinococcus granulosus	tm gpcr rhodopsin	0.0038	0.0455	0.0455
Echinococcus granulosus	neuropeptides capa receptor	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Onchocerca volvulus	Neuropeptide F receptor homolog	0.0038	0.0455	0.0455
Onchocerca volvulus		0.0038	0.0455	0.0455
Echinococcus multilocularis	farnesyl pyrophosphate synthase	0.0124	0.6005	0.6005
Onchocerca volvulus		0.0038	0.0455	0.0455
Echinococcus multilocularis	neuropeptide s receptor	0.0038	0.0455	0.0455
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0038	0.0455	0.0455
Brugia malayi	Dopamine receptor protein 1	0.0038	0.0455	0.0455
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0038	0.0455	0.0455
Brugia malayi	Dopamine receptor	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Echinococcus granulosus	rhodopsin orphan GPCR	0.0038	0.0455	0.0455
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0038	0.0455	0.0455
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0038	0.0455	0.0455
Onchocerca volvulus		0.0038	0.0455	0.0455
Schistosoma mansoni	amine GPCR	0.0038	0.0455	0.0455
Echinococcus granulosus	neuropeptide FF receptor 2	0.0038	0.0455	0.0455
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0038	0.0455	0.0455
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Echinococcus multilocularis	voltage dependent calcium channel type d subunit	0.0076	0.2893	0.2893
Schistosoma mansoni	neuropeptide receptor	0.0038	0.0455	0.0455
Echinococcus multilocularis	dro:myosuppressin receptor	0.0038	0.0455	0.0455
Brugia malayi	hypothetical protein	0.0038	0.0455	0.0455
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0038	0.0455	0.0455
Schistosoma mansoni	voltage-gated cation channel	0.0076	0.2893	0.2893
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0038	0.0455	0.0455
Echinococcus granulosus	voltage dependent L type calcium channel subunit\|voltage dependent calcium channel	0.0076	0.2893	0.2893
Treponema pallidum	sodium- and chloride- dependent transporter	0.0185	1	0.5
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0038	0.0455	0.0455
Brugia malayi	G-protein coupled receptor	0.0038	0.0455	0.0455
Schistosoma mansoni	amine GPCR	0.0038	0.0455	0.0455
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0038	0.0455	0.0455
Echinococcus multilocularis	sex peptide receptor	0.0038	0.0455	0.0455
Echinococcus granulosus	hypothetical protein	0.0038	0.0455	0.0455
Echinococcus multilocularis	voltage dependent calcium channel	0.0076	0.2893	0.2893
Echinococcus multilocularis	g protein coupled receptor	0.0038	0.0455	0.0455
Onchocerca volvulus		0.0185	1	1
Echinococcus granulosus	neuropeptide s receptor	0.0038	0.0455	0.0455
Loa Loa (eye worm)	polyprenyl synthetase	0.0124	0.6005	0.6005
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0038	0.0455	0.0455
Onchocerca volvulus		0.0038	0.0455	0.0455
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0038	0.0455	0.0455
Brugia malayi	putative neuropeptide receptor NPR1	0.0038	0.0455	0.0455
Echinococcus granulosus	biogenic amine 5HT receptor	0.0038	0.0455	0.0455
Echinococcus multilocularis	g protein coupled receptor	0.0038	0.0455	0.0455
Brugia malayi	hypothetical protein	0.0038	0.0455	0.0455
Echinococcus granulosus	somatostatin receptor	0.0038	0.0455	0.0455
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0038	0.0455	0.0455
Echinococcus granulosus	farnesyl pyrophosphate synthase	0.0124	0.6005	0.6005
Echinococcus granulosus	tm gpcr rhodopsin	0.0038	0.0455	0.0455
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0038	0.0455	0.0455
Echinococcus granulosus	G protein coupled receptor 139	0.0038	0.0455	0.0455
Echinococcus granulosus	neuropeptide receptor	0.0038	0.0455	0.0455
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0038	0.0455	0.0455
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.0038	0.0455	0.0455
Schistosoma mansoni	neuropeptide F-like receptor	0.0038	0.0455	0.0455
Echinococcus multilocularis	fmrfamide receptor	0.0038	0.0455	0.0455
Loa Loa (eye worm)	neuropeptide F receptor	0.0038	0.0455	0.0455
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0038	0.0455	0.0455
Onchocerca volvulus		0.0038	0.0455	0.0455
Mycobacterium ulcerans	geranylgeranyl pyrophosphate synthase	0.0124	0.6005	0.5
Schistosoma mansoni	neuropeptide receptor	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0185	1	1
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0038	0.0455	0.0455
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0038	0.0455	0.0455
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0038	0.0455	0.0455
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0038	0.0455	0.0455
Loa Loa (eye worm)	solute carrier family 6 member 4	0.0185	1	1
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Echinococcus granulosus	7TM GPCR rhodopsin	0.0038	0.0455	0.0455
Schistosoma mansoni	neuropeptide receptor	0.0038	0.0455	0.0455
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Echinococcus multilocularis	serotonin transporter	0.0185	1	1
Echinococcus multilocularis	sodium channel protein	0.0032	0.005	0.005
Brugia malayi	hypothetical protein	0.0038	0.0455	0.0455
Echinococcus multilocularis	neuropeptide Y receptor	0.0038	0.0455	0.0455
Schistosoma mansoni	histamine h1 receptor	0.0038	0.0455	0.0455
Loa Loa (eye worm)	norepinephrine transporter	0.0185	1	1
Trichomonas vaginalis	geranylgeranyl pyrophosphate synthase, putative	0.0124	0.6005	0.5
Loa Loa (eye worm)	serotonin transporter b	0.0185	1	1
Brugia malayi	GnHR receptor homolog	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0038	0.0455	0.0455
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0038	0.0455	0.0455
Echinococcus multilocularis	voltage dependent calcium channel type d subunit	0.0076	0.2893	0.2893
Onchocerca volvulus		0.0038	0.0455	0.0455
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0038	0.0455	0.0455
Schistosoma mansoni	opsin-like receptor	0.0038	0.0455	0.0455
Echinococcus granulosus	voltage dependent calcium channel type d subunit\|voltage dependent calcium channel alpha 1	0.0076	0.2893	0.2893
Echinococcus granulosus	serotonin transporter	0.0185	1	1
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0038	0.0455	0.0455
Brugia malayi	Melatonin receptor type 1A	0.0038	0.0455	0.0455
Brugia malayi	Serotonin receptor	0.0038	0.0455	0.0455
Echinococcus granulosus	g-protein coupled receptor	0.0038	0.0455	0.0455
Trichomonas vaginalis	geranylgeranyl pyrophosphate synthase, putative	0.0124	0.6005	0.5
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Onchocerca volvulus		0.0038	0.0455	0.0455
Loa Loa (eye worm)	neuropeptide F receptor	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0076	0.2893	0.2893
Onchocerca volvulus		0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Echinococcus granulosus	rhodopsin orphan GPCR	0.0038	0.0455	0.0455
Echinococcus granulosus	allatostatin A receptor	0.0038	0.0455	0.0455
Schistosoma mansoni	norepinephrine/norepinephrine transporter	0.0185	1	1
Schistosoma mansoni	myosin xvIII	0.0038	0.0455	0.0455
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Echinococcus granulosus	rhodopsin orphan GPCR	0.0038	0.0455	0.0455
Echinococcus multilocularis	voltage dependent L type calcium channel subunit	0.0076	0.2893	0.2893
Toxoplasma gondii	polyprenyl synthetase superfamily protein	0.0124	0.6005	1
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Schistosoma mansoni	neuropeptide f receptor 76f	0.0038	0.0455	0.0455
Echinococcus multilocularis	allatostatin A receptor	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Onchocerca volvulus		0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Onchocerca volvulus		0.0038	0.0455	0.0455
Echinococcus multilocularis	serotonin receptor	0.0038	0.0455	0.0455
Brugia malayi	Voltage-gated calcium channel, L-type, alpha subunit. C. elegans egl-19 ortholog	0.0076	0.2893	0.2893
Loa Loa (eye worm)	melatonin receptor type 1A	0.0038	0.0455	0.0455
Echinococcus granulosus	rhodopsin orphan GPCR	0.0038	0.0455	0.0455
Brugia malayi	hypothetical protein	0.0038	0.0455	0.0455
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0038	0.0455	0.0455
Schistosoma mansoni	high voltage-activated calcium channel Cav1	0.0076	0.2893	0.2893
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0038	0.0455	0.0455
Brugia malayi	hypothetical protein	0.0038	0.0455	0.0455
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0185	1	1
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Echinococcus granulosus	rhodopsin orphan GPCR	0.0038	0.0455	0.0455
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0038	0.0455	0.0455
Echinococcus granulosus	rhodopsin orphan GPCR	0.0038	0.0455	0.0455
Onchocerca volvulus		0.0038	0.0455	0.0455
Echinococcus granulosus	neuropeptides capa receptor	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Echinococcus granulosus	fmrfamide receptor	0.0038	0.0455	0.0455
Schistosoma mansoni	hypothetical protein	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Brugia malayi	neuropeptide F receptor	0.0038	0.0455	0.0455
Trypanosoma brucei	farnesyl pyrophosphate synthase	0.0124	0.6005	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0038	0.0455	0.0455
Brugia malayi	neuropeptide F receptor	0.0038	0.0455	0.0455
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0038	0.0455	0.0455
Echinococcus multilocularis	neuropeptides capa receptor	0.0038	0.0455	0.0455
Echinococcus multilocularis	neuropeptide Y receptor	0.0038	0.0455	0.0455
Brugia malayi	hypothetical protein	0.0038	0.0455	0.0455
Brugia malayi	AKH receptor	0.0038	0.0455	0.0455
Leishmania major	farnesyl pyrophosphate synthase	0.0124	0.6005	0.5
Brugia malayi	G-protein coupled receptor	0.0038	0.0455	0.0455
Echinococcus granulosus	neuropeptide receptor	0.0038	0.0455	0.0455
Schistosoma mansoni	farnesyl pyrophosphate synthase	0.0124	0.6005	0.6005
Brugia malayi	follicle stimulating hormone receptor	0.0038	0.0455	0.0455
Brugia malayi	larval opioid receptor	0.0038	0.0455	0.0455
Echinococcus multilocularis	voltage dependent calcium channel	0.0076	0.2893	0.2893
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Brugia malayi	G protein-coupled receptor	0.0038	0.0455	0.0455
Schistosoma mansoni	biogenic amine receptor	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Echinococcus multilocularis	g-protein coupled receptor	0.0038	0.0455	0.0455
Brugia malayi	Dopamine receptor protein 2	0.0038	0.0455	0.0455
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0038	0.0455	0.0455
Brugia malayi	sulfakinin receptor protein	0.0038	0.0455	0.0455
Echinococcus granulosus	orexin receptor type 2	0.0038	0.0455	0.0455
Echinococcus multilocularis	G protein coupled receptor 139	0.0038	0.0455	0.0455
Plasmodium falciparum	geranylgeranyl pyrophosphate synthase, putative	0.0124	0.6005	1
Echinococcus granulosus	neuropeptide Y receptor	0.0038	0.0455	0.0455
Trichomonas vaginalis	geranylgeranyl diphosphate synthase, putative	0.0124	0.6005	0.5
Echinococcus multilocularis	neuropeptide receptor	0.0038	0.0455	0.0455
Echinococcus granulosus	voltage dependent calcium channel	0.0076	0.2893	0.2893
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0038	0.0455	0.0455
Schistosoma mansoni	hypothetical protein	0.0038	0.0455	0.0455
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0038	0.0455	0.0455
Onchocerca volvulus		0.0038	0.0455	0.0455
Echinococcus multilocularis	neuropeptides capa receptor	0.0038	0.0455	0.0455
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0038	0.0455	0.0455
Schistosoma mansoni	opsin-like receptor	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Mycobacterium tuberculosis	Probable geranylgeranyl pyrophosphate synthetase IdsA2 (ggppsase) (GGPP synthetase) (geranylgeranyl diphosphate synthase)	0.0124	0.6005	0.5
Echinococcus multilocularis	orexin receptor type 2	0.0038	0.0455	0.0455
Mycobacterium ulcerans	geranylgeranyl pyrophosphate synthase	0.0124	0.6005	0.5
Loa Loa (eye worm)	G-protein coupled receptor	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0185	1	1
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Loa Loa (eye worm)	G-protein coupled receptor	0.0038	0.0455	0.0455
Echinococcus granulosus	voltage gated sodium channel Nav1 alpha subunit	0.0032	0.005	0.005
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0038	0.0455	0.0455
Brugia malayi	Serotonin receptor	0.0038	0.0455	0.0455
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0038	0.0455	0.0455
Echinococcus granulosus	neuropeptide Y receptor	0.0038	0.0455	0.0455
Echinococcus multilocularis	fmrfamide receptor	0.0038	0.0455	0.0455
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0038	0.0455	0.0455
Echinococcus granulosus	tm gpcr rhodopsin	0.0038	0.0455	0.0455
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Echinococcus granulosus	g protein coupled receptor	0.0038	0.0455	0.0455
Echinococcus multilocularis	g protein coupled receptor	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Echinococcus granulosus	biogenic amine 5HT receptor	0.0038	0.0455	0.0455
Onchocerca volvulus		0.0038	0.0455	0.0455
Echinococcus granulosus	serotonin receptor	0.0038	0.0455	0.0455
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0038	0.0455	0.0455
Chlamydia trachomatis	Ssodium-dependent amino acid transporter	0.0031	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Loa Loa (eye worm)	TYRA-2 protein	0.0038	0.0455	0.0455
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Echinococcus granulosus	7tm_1 domain containing protein	0.0038	0.0455	0.0455
Trypanosoma cruzi	farnesyl pyrophosphate synthase	0.0124	0.6005	1
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Echinococcus multilocularis	serotonin receptor	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Schistosoma mansoni	neuropeptide receptor	0.0038	0.0455	0.0455
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Schistosoma mansoni	hypothetical protein	0.0038	0.0455	0.0455
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0038	0.0455	0.0455
Brugia malayi	hypothetical protein	0.0038	0.0455	0.0455
Onchocerca volvulus		0.0038	0.0455	0.0455
Schistosoma mansoni	adenoreceptor	0.0038	0.0455	0.0455
Echinococcus multilocularis	neuropeptide receptor A26	0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0038	0.0455	0.0455
Onchocerca volvulus		0.0038	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0038	0.0455	0.0455
Echinococcus multilocularis	somatostatin receptor	0.0038	0.0455	0.0455
Onchocerca volvulus		0.0038	0.0455	0.0455
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0038	0.0455	0.0455
Brugia malayi	hypothetical protein	0.0038	0.0455	0.0455
Giardia lamblia	Farnesyl diphosphate synthase	0.0124	0.6005	0.5
Brugia malayi	Polyprenyl synthetase family protein	0.0124	0.6005	0.6005
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0455	0.0455
Schistosoma mansoni	hypothetical protein	0.0038	0.0455	0.0455

Activities

Activity type	Activity value	Assay description	Source	Reference
EC50 (functional)	= 4.5 uM	Effective concentration of the compound against human Gamma delta T cells	ChEMBL.	15828834
IC50 (functional)	= 0.22 uM	In vitro inhibitory concentration against bone resorption in 17 day old fetal mouse metatarsals	ChEMBL.	15828834
IC50 (functional)	= 0.22 uM	In vitro inhibitory concentration against bone resorption in 17 day old fetal mouse metatarsals	ChEMBL.	15828834
IC50 (functional)	= 1.5 uM	Inhibitory concentration of the compound against Dictyostelium discoideum cell growth	ChEMBL.	15828834
IC50 (functional)	= 1.5 uM	Inhibitory concentration of the compound against Dictyostelium discoideum cell growth	ChEMBL.	15828834
IC50 (functional)	= 52.6 uM	Antiproliferative activity against human SF-268 cell line by MTT assay	ChEMBL.	16970405
IC50 (functional)	= 52.6 uM	Antiproliferative activity against human SF-268 cell line by MTT assay	ChEMBL.	16970405
IC50 (functional)	= 66.8 uM	Antiproliferative activity against human NCI-H460 cell line by MTT assay	ChEMBL.	16970405
IC50 (functional)	= 66.8 uM	Antiproliferative activity against human NCI-H460 cell line by MTT assay	ChEMBL.	16970405
IC50 (functional)	= 98.1 uM	Antiproliferative activity against human MCF7 cell line by MTT assay	ChEMBL.	16970405
IC50 (functional)	= 98.1 uM	Antiproliferative activity against human MCF7 cell line by MTT assay	ChEMBL.	16970405
IC50 (binding)	= 540 uM	Inhibition of Aquifex aeolicus IspH expressed in Escherichia coli BL21 (DE3) using HMBPP substrate	ChEMBL.	20426416
Ki (binding)	= 38 nM	Binding affinity towards Farnesyl diphosphate synthase from leishmania major	ChEMBL.	15828834
Ki (binding)	= 38 nM	Binding affinity towards Farnesyl diphosphate synthase from leishmania major	ChEMBL.	15828834

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Dictyostelium discoideum	ChEMBL23	15828834
Mus musculus	ChEMBL23	15828834

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: CHEMBL193356
PubChem: 11335461

Bibliographic References

2 literature references were collected for this gene.

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Detailed information for compound 335397