TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 479.467 | Formula: C21H30N5O6P
H donors: 3 H acceptors: 7 LogP: 2.02 Rotable bonds: 14
Rule of 5 violations (Lipinski): 1
SMILES: CCCCP(=O)(C1=CC[C@@H](C1)NC(=O)CCCCCNc1ccc(c2c1non2)[N+](=O)[O-])O
InChi: 1S/C21H30N5O6P/c1-2-3-13-33(30,31)16-9-8-15(14-16)23-19(27)7-5-4-6-12-22-17-10-11-18(26(28)29)21-20(17)24-32-25-21/h9-11,15,22H,2-8,12-14H2,1H3,(H,23,27)(H,30,31)/t15-/m0/s1
InChiKey: GDIVWRNNXLWAKH-HNNXBMFYSA-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)	unidentified vitellogenin-linked transcript protein 6	0.0045	0.0132	0.015
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0045	0.0132	0.0341
Echinococcus granulosus	rhodopsin orphan GPCR	0.0045	0.0132	0.0341
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0045	0.0132	0.0341
Trypanosoma brucei	flap endonuclease-1 (FEN-1), putative	0.0053	0.019	1
Brugia malayi	neuropeptide F receptor	0.0045	0.0132	0.015
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0045	0.0132	0.0341
Brugia malayi	hypothetical protein	0.0045	0.0132	0.015
Schistosoma mansoni	neuropeptide receptor	0.0045	0.0132	0.0341
Brugia malayi	Serotonin receptor	0.0045	0.0132	0.015
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0045	0.0132	0.0341
Brugia malayi	G protein-coupled receptor	0.0045	0.0132	0.015
Echinococcus granulosus	rhodopsin orphan GPCR	0.0045	0.0132	0.0341
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0045	0.0132	0.0341
Echinococcus granulosus	hypothetical protein	0.0045	0.0132	0.0341
Echinococcus multilocularis	orexin receptor type 2	0.0045	0.0132	0.0341
Echinococcus multilocularis	g protein coupled receptor	0.0045	0.0132	0.0341
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0045	0.0132	0.0341
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0045	0.0132	0.0341
Brugia malayi	neuropeptide F receptor	0.0045	0.0132	0.015
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0045	0.0132	0.0341
Echinococcus granulosus	biogenic amine 5HT receptor	0.0045	0.0132	0.0341
Toxoplasma gondii	histone lysine methyltransferase SET8	0.0578	0.3861	1
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.1282	0.878	1
Echinococcus granulosus	histone lysine n methyltransferase setd8	0.0578	0.3861	1
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0045	0.0132	0.0341
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0045	0.0132	0.015
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0045	0.0132	0.0341
Echinococcus granulosus	rhodopsin orphan GPCR	0.0045	0.0132	0.0341
Echinococcus granulosus	rhodopsin orphan GPCR	0.0045	0.0132	0.0341
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0045	0.0132	0.0341
Onchocerca volvulus		0.0045	0.0132	0.0132
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0045	0.0132	0.015
Schistosoma mansoni	histone-lysine n-methyltransferase seto7	0.0578	0.3861	1
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0045	0.0132	0.0341
Plasmodium vivax	SET domain protein, putative	0.02	0.122	0.3158
Toxoplasma gondii	isocitrate dehydrogenase	0.0049	0.0165	0.0428
Trichomonas vaginalis	flap endonuclease-1, putative	0.0053	0.019	0.019
Loa Loa (eye worm)	hypothetical protein	0.0578	0.3861	0.4398
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Brugia malayi	AKH receptor	0.0045	0.0132	0.015
Loa Loa (eye worm)	neuropeptide F receptor	0.0045	0.0132	0.015
Plasmodium vivax	flap endonuclease 1, putative	0.0053	0.019	0.0491
Brugia malayi	Pre-SET motif family protein	0.1282	0.878	1
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0174	0.1039	0.2691
Brugia malayi	Flap endonuclease-1	0.0053	0.019	0.0216
Schistosoma mansoni	NADP-specific isocitrate dehydrogenase	0.0049	0.0165	0.0428
Brugia malayi	ORL1-like opioid receptor	0.0045	0.0132	0.015
Loa Loa (eye worm)	flap endonuclease-1	0.0053	0.019	0.0216
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0045	0.0132	0.0341
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Schistosoma mansoni	growth hormone secretagogue receptor	0.0045	0.0132	0.0341
Brugia malayi	G-protein coupled receptor	0.0045	0.0132	0.015
Echinococcus granulosus	biogenic amine 5HT receptor	0.0045	0.0132	0.0341
Loa Loa (eye worm)	melatonin receptor type 1A	0.0045	0.0132	0.015
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0045	0.0132	0.0341
Echinococcus granulosus	flap endonuclease 1	0.0053	0.019	0.0491
Echinococcus granulosus	tm gpcr rhodopsin	0.0045	0.0132	0.0341
Schistosoma mansoni	amine GPCR	0.0045	0.0132	0.0341
Brugia malayi	Dopamine receptor	0.0045	0.0132	0.015
Plasmodium vivax	SET domain protein, putative	0.0578	0.3861	1
Brugia malayi	hypothetical protein	0.0045	0.0132	0.015
Onchocerca volvulus		0.0045	0.0132	0.0132
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0045	0.0132	0.0341
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Loa Loa (eye worm)	TYRA-2 protein	0.0045	0.0132	0.015
Echinococcus multilocularis	isocitrate dehydrogenase 2 (NADP+)	0.0049	0.0165	0.0428
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0045	0.0132	0.015
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0045	0.0132	0.0341
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0049	0.0165	0.0428
Echinococcus granulosus	neuropeptide receptor A26	0.0045	0.0132	0.0341
Brugia malayi	hypothetical protein	0.0045	0.0132	0.015
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0045	0.0132	0.0341
Brugia malayi	Pre-SET motif family protein	0.02	0.122	0.1389
Schistosoma mansoni	flap endonuclease-1	0.0048	0.0154	0.0399
Echinococcus granulosus	neuropeptide receptor	0.0045	0.0132	0.0341
Brugia malayi	Isocitrate dehydrogenase	0.0049	0.0165	0.0188
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Echinococcus granulosus	7TM GPCR rhodopsin	0.0045	0.0132	0.0341
Onchocerca volvulus		0.0045	0.0132	0.0132
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0049	0.0165	0.0428
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.02	0.122	0.3158
Brugia malayi	follicle stimulating hormone receptor	0.0045	0.0132	0.015
Echinococcus granulosus	somatostatin receptor	0.0045	0.0132	0.0341
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0049	0.0165	0.0428
Schistosoma mansoni	opsin-like receptor	0.0045	0.0132	0.0341
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Echinococcus granulosus	7tm_1 domain containing protein	0.0045	0.0132	0.0341
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0045	0.0132	0.0341
Onchocerca volvulus		0.02	0.122	0.122
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0045	0.0132	0.0341
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0045	0.0132	0.0341
Echinococcus multilocularis	histone lysine n methyltransferase setd8	0.0578	0.3861	1
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0045	0.0132	0.015
Trypanosoma brucei	isocitrate dehydrogenase, putative	0.0049	0.0165	0.8718
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0045	0.0132	0.0341
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0045	0.0132	0.015
Brugia malayi	larval opioid receptor	0.0045	0.0132	0.015
Entamoeba histolytica	Flap nuclease, putative	0.0053	0.019	1
Onchocerca volvulus	Dopamine\/Ecdysteroid receptor homolog	0.0045	0.0132	0.0132
Echinococcus granulosus	neuropeptide FF receptor 2	0.0045	0.0132	0.0341
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Echinococcus granulosus	NADP dependent isocitrate dehydrogenase	0.0049	0.0165	0.0428
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0045	0.0132	0.0341
Brugia malayi	hypothetical protein	0.0045	0.0132	0.015
Echinococcus multilocularis	neuropeptide Y receptor	0.0045	0.0132	0.0341
Echinococcus granulosus	g protein coupled receptor	0.0045	0.0132	0.0341
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.02	0.122	0.3158
Onchocerca volvulus		0.0045	0.0132	0.0132
Brugia malayi	Serotonin receptor	0.0045	0.0132	0.015
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Giardia lamblia	Flap structure-specific endonuclease	0.0053	0.019	1
Echinococcus multilocularis	serotonin receptor	0.0045	0.0132	0.0341
Onchocerca volvulus		0.0045	0.0132	0.0132
Echinococcus granulosus	orexin receptor type 2	0.0045	0.0132	0.0341
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0045	0.0132	0.0341
Onchocerca volvulus		0.0045	0.0132	0.0132
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0045	0.0132	0.0341
Schistosoma mansoni	biogenic amine receptor	0.0045	0.0132	0.0341
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0045	0.0132	0.0341
Brugia malayi	Dopamine receptor protein 2	0.0045	0.0132	0.015
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0045	0.0132	0.0341
Chlamydia trachomatis	hypothetical protein	0.0026	0	0.5
Echinococcus granulosus	g protein coupled receptor	0.0045	0.0132	0.0341
Loa Loa (eye worm)	G-protein coupled receptor	0.0045	0.0132	0.015
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0045	0.0132	0.0341
Schistosoma mansoni	myosin xvIII	0.0045	0.0132	0.0341
Echinococcus multilocularis	neuropeptides capa receptor	0.0045	0.0132	0.0341
Echinococcus granulosus	g-protein coupled receptor	0.0045	0.0132	0.0341
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0045	0.0132	0.0341
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Brugia malayi	hypothetical protein	0.0045	0.0132	0.015
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Schistosoma mansoni	hypothetical protein	0.0045	0.0132	0.0341
Echinococcus granulosus	neuropeptide receptor	0.0045	0.0132	0.0341
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0045	0.0132	0.0341
Echinococcus multilocularis	fmrfamide receptor	0.0045	0.0132	0.0341
Onchocerca volvulus		0.0045	0.0132	0.0132
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Mycobacterium tuberculosis	Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP)	0.0049	0.0165	0.5
Brugia malayi	hypothetical protein	0.0045	0.0132	0.015
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Leishmania major	flap endonuclease-1 (FEN-1), putative	0.0053	0.019	1
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0045	0.0132	0.0341
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.02	0.122	0.3158
Brugia malayi	isocitrate dehydrogenase	0.0049	0.0165	0.0188
Onchocerca volvulus		0.0045	0.0132	0.0132
Onchocerca volvulus		0.0045	0.0132	0.0132
Schistosoma mansoni	hypothetical protein	0.0045	0.0132	0.0341
Brugia malayi	Protein set-1	0.0578	0.3861	0.4398
Brugia malayi	GnHR receptor homolog	0.0045	0.0132	0.015
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.02	0.122	0.3158
Brugia malayi	hypothetical protein	0.0045	0.0132	0.015
Trypanosoma brucei	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0049	0.0165	0.8718
Echinococcus multilocularis	neuropeptide receptor	0.0045	0.0132	0.0341
Echinococcus multilocularis	dro:myosuppressin receptor	0.0045	0.0132	0.0341
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0045	0.0132	0.0341
Echinococcus multilocularis	flap endonuclease 1	0.0053	0.019	0.0491
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Echinococcus granulosus	g protein coupled receptor	0.0045	0.0132	0.0341
Brugia malayi	Melatonin receptor type 1A	0.0045	0.0132	0.015
Schistosoma mansoni	neuropeptide receptor	0.0045	0.0132	0.0341
Schistosoma mansoni	neuropeptide receptor	0.0045	0.0132	0.0341
Schistosoma mansoni	hypothetical protein	0.0045	0.0132	0.0341
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0045	0.0132	0.0341
Echinococcus granulosus	sex peptide receptor	0.0045	0.0132	0.0341
Schistosoma mansoni	neuropeptide f receptor 76f	0.0045	0.0132	0.0341
Echinococcus multilocularis	neuropeptide Y receptor	0.0045	0.0132	0.0341
Echinococcus multilocularis	serotonin receptor	0.0045	0.0132	0.0341
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0045	0.0132	0.0341
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0045	0.0132	0.0341
Brugia malayi	hypothetical protein	0.0045	0.0132	0.015
Echinococcus granulosus	tm gpcr rhodopsin	0.0045	0.0132	0.0341
Schistosoma mansoni	neuropeptide receptor	0.0045	0.0132	0.0341
Schistosoma mansoni	neuropeptide F-like receptor	0.0045	0.0132	0.0341
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Echinococcus multilocularis	G protein coupled receptor 139	0.0045	0.0132	0.0341
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Echinococcus granulosus	tm gpcr rhodopsin	0.0045	0.0132	0.0341
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0045	0.0132	0.0341
Brugia malayi	G protein-coupled receptor F59B2.13	0.0045	0.0132	0.015
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0045	0.0132	0.0341
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0045	0.0132	0.0341
Toxoplasma gondii	isocitrate dehydrogenase	0.0049	0.0165	0.0428
Schistosoma mansoni	histamine h1 receptor	0.0045	0.0132	0.0341
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0045	0.0132	0.0341
Brugia malayi	Dopamine receptor protein 1	0.0045	0.0132	0.015
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0045	0.0132	0.015
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0045	0.0132	0.0341
Echinococcus multilocularis	fmrfamide receptor	0.0045	0.0132	0.0341
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0045	0.0132	0.0341
Brugia malayi	G-protein coupled receptor	0.0045	0.0132	0.015
Onchocerca volvulus		0.0045	0.0132	0.0132
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0045	0.0132	0.0341
Echinococcus multilocularis	sex peptide receptor	0.0045	0.0132	0.0341
Onchocerca volvulus		0.0045	0.0132	0.0132
Onchocerca volvulus		0.0045	0.0132	0.0132
Echinococcus multilocularis	allatostatin A receptor	0.0045	0.0132	0.0341
Schistosoma mansoni	adenoreceptor	0.0045	0.0132	0.0341
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0045	0.0132	0.0341
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0045	0.0132	0.0341
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0045	0.0132	0.0341
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Brugia malayi	putative neuropeptide receptor NPR1	0.0045	0.0132	0.015
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0045	0.0132	0.015
Echinococcus granulosus	fmrfamide receptor	0.0045	0.0132	0.0341
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.02	0.122	0.3158
Echinococcus multilocularis	isocitrate dehydrogenase	0.0049	0.0165	0.0428
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0045	0.0132	0.0341
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0045	0.0132	0.0341
Trichomonas vaginalis	set domain proteins, putative	0.1457	1	1
Brugia malayi	hypothetical protein	0.0045	0.0132	0.015
Echinococcus granulosus	rhodopsin orphan GPCR	0.0045	0.0132	0.0341
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.02	0.122	0.3158
Schistosoma mansoni	hypothetical protein	0.0045	0.0132	0.0341
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Schistosoma mansoni	amine GPCR	0.0045	0.0132	0.0341
Onchocerca volvulus		0.0045	0.0132	0.0132
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0045	0.0132	0.0341
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Brugia malayi	sulfakinin receptor protein	0.0045	0.0132	0.015
Loa Loa (eye worm)	neuropeptide F receptor	0.0045	0.0132	0.015
Echinococcus granulosus	neuropeptide Y receptor	0.0045	0.0132	0.0341
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0045	0.0132	0.0341
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0045	0.0132	0.015
Brugia malayi	RE15519p	0.0045	0.0132	0.015
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Trypanosoma cruzi	isocitrate dehydrogenase, putative	0.0049	0.0165	0.8718
Schistosoma mansoni	biogenic amine receptor	0.0045	0.0132	0.0341
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0045	0.0132	0.0341
Trypanosoma cruzi	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0049	0.0165	0.8718
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0045	0.0132	0.0341
Echinococcus granulosus	dro:myosuppressin receptor	0.0045	0.0132	0.0341
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0045	0.0132	0.015
Echinococcus multilocularis	neuropeptide receptor	0.0045	0.0132	0.0341
Leishmania major	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0049	0.0165	0.8718
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0045	0.0132	0.0341
Schistosoma mansoni	biogenic amine receptor	0.0045	0.0132	0.0341
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0045	0.0132	0.0341
Plasmodium falciparum	flap endonuclease 1	0.0053	0.019	0.0491
Echinococcus granulosus	G protein coupled receptor 139	0.0045	0.0132	0.0341
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0045	0.0132	0.0341
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Onchocerca volvulus		0.0045	0.0132	0.0132
Brugia malayi	putative neuropeptide receptor	0.0045	0.0132	0.015
Echinococcus granulosus	neuropeptide Y receptor	0.0045	0.0132	0.0341
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0045	0.0132	0.0341
Schistosoma mansoni	opsin-like receptor	0.0045	0.0132	0.0341
Echinococcus granulosus	allatostatin A receptor	0.0045	0.0132	0.0341
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0045	0.0132	0.0341
Schistosoma mansoni	neuropeptide F-like receptor	0.0045	0.0132	0.0341
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.0045	0.0132	0.015
Plasmodium falciparum	isocitrate dehydrogenase [NADP], mitochondrial	0.0049	0.0165	0.0428
Echinococcus granulosus	rhodopsin orphan GPCR	0.0045	0.0132	0.0341
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0045	0.0132	0.0341
Trypanosoma cruzi	flap endonuclease-1 (FEN-1), putative	0.0053	0.019	1
Onchocerca volvulus	Neuropeptide F receptor homolog	0.0045	0.0132	0.0132
Loa Loa (eye worm)	G-protein coupled receptor	0.0045	0.0132	0.015
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.02	0.122	0.3158
Schistosoma mansoni	amine GPCR	0.0045	0.0132	0.0341
Toxoplasma gondii	flap structure-specific endonuclease 1, putative	0.0053	0.019	0.0491
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Echinococcus granulosus	neuropeptides capa receptor	0.0045	0.0132	0.0341
Echinococcus multilocularis	g protein coupled receptor	0.0045	0.0132	0.0341
Schistosoma mansoni	amine GPCR	0.0045	0.0132	0.0341
Loa Loa (eye worm)	hypothetical protein	0.02	0.122	0.1389
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Echinococcus granulosus	serotonin receptor	0.0045	0.0132	0.0341
Onchocerca volvulus		0.0045	0.0132	0.0132
Echinococcus granulosus	neuropeptides capa receptor	0.0045	0.0132	0.0341
Schistosoma mansoni	opsin-like receptor	0.0045	0.0132	0.0341
Onchocerca volvulus		0.0045	0.0132	0.0132
Echinococcus granulosus	histone lysine methyltransferase setb	0.02	0.122	0.3158
Echinococcus multilocularis	neuropeptides capa receptor	0.0045	0.0132	0.0341
Echinococcus granulosus	neuropeptide s receptor	0.0045	0.0132	0.0341
Echinococcus multilocularis	neuropeptide s receptor	0.0045	0.0132	0.0341
Loa Loa (eye worm)	isocitrate dehydrogenase	0.0049	0.0165	0.0188
Echinococcus multilocularis	neuropeptide receptor A26	0.0045	0.0132	0.0341
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0045	0.0132	0.0341
Onchocerca volvulus		0.0045	0.0132	0.0132
Plasmodium falciparum	SET domain protein, putative	0.0578	0.3861	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.0045	0.0132	0.0341
Brugia malayi	hypothetical protein	0.0045	0.0132	0.015
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0045	0.0132	0.0341
Echinococcus multilocularis	g-protein coupled receptor	0.0045	0.0132	0.0341
Plasmodium vivax	isocitrate dehydrogenase [NADP], mitochondrial, putative	0.0049	0.0165	0.0428
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0132	0.015
Schistosoma mansoni	amine GPCR	0.0045	0.0132	0.0341
Echinococcus multilocularis	somatostatin receptor	0.0045	0.0132	0.0341
Echinococcus multilocularis	g protein coupled receptor	0.0045	0.0132	0.0341

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 193.27 uM	Antagonist activity at human GABAC rho1 receptor expressed in Xenopus laevis oocytes assessed as inhibition of GABA-induced current preincubated for 5 mins by two electrode voltage clamp assay	ChEMBL.	24900684
IC50 (binding)	= 281.42 uM	Antagonist activity at human GABAC rho1 receptor expressed in Xenopus laevis oocytes assessed as inhibition of GABA-induced current by two electrode voltage clamp assay	ChEMBL.	24900684
Inhibition (binding)		Antagonist activity at human GABAA alpha1beta2gamma2L receptor expressed in Xenopus laevis oocytes assessed as inhibition of GABA-induced current at 300 uM by two electrode voltage clamp assay relative to control	ChEMBL.	24900684

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: CHEMBL2337486

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1731118