TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 611.696 | Formula: C28H32F3N3O5S2
H donors: 2 H acceptors: 4 LogP: 4.69 Rotable bonds: 10
Rule of 5 violations (Lipinski): 2
SMILES: OC[C@@H](N1C[C@@H](C)[C@H](CN(Cc2ccc(cc2)C(F)(F)F)C)Oc2c(C1=O)cccc2NS(=O)(=O)c1cccs1)C
InChi: 1S/C28H32F3N3O5S2/c1-18-14-34(19(2)17-35)27(36)22-6-4-7-23(32-41(37,38)25-8-5-13-40-25)26(22)39-24(18)16-33(3)15-20-9-11-21(12-10-20)28(29,30)31/h4-13,18-19,24,32,35H,14-17H2,1-3H3/t18-,19+,24+/m1/s1
InChiKey: AHUZFXYFUYFNSB-IMWIBFENSA-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
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0011	0.001	0.0005
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Schistosoma mansoni	tyrosine kinase	0.0117	0.0399	0.0394
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0011	0.001	0.0005
Schistosoma mansoni	chromobox protein	0.0061	0.0192	0.0187
Schistosoma mansoni	tyrosine kinase	0.012	0.0411	0.0406
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0011	0.001	0.0005
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0011	0.001	0.0005
Schistosoma mansoni	tyrosine kinase	0.0248	0.0881	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Loa Loa (eye worm)	hypothetical protein	0.001	0.0005	0.0005
Schistosoma mansoni	amine GPCR	0.0011	0.001	0.0005
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.0011	0.001	0.001
Echinococcus multilocularis	fmrfamide receptor	0.0011	0.001	0.0005
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0011	0.001	0.0005
Onchocerca volvulus		0.0011	0.001	0.0475
Brugia malayi	hypothetical protein	0.0011	0.001	0.0005
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0053	0.0164	0.0159
Echinococcus granulosus	allatostatin A receptor	0.0011	0.001	0.0005
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0011	0.001	0.0005
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0011	0.001	0.0005
Echinococcus granulosus	neuropeptides capa receptor	0.0011	0.001	0.0005
Brugia malayi	hypothetical protein	0.0011	0.001	0.0005
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Echinococcus multilocularis	cpg binding protein	0.0026	0.0066	0.0061
Trichomonas vaginalis	chromobox protein, putative	0.0037	0.0103	0.0526
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Treponema pallidum	fructose-bisphosphate aldolase	0.0517	0.1869	0.5
Echinococcus multilocularis	neuropeptides capa receptor	0.0011	0.001	0.0005
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0011	0.001	0.0005
Mycobacterium tuberculosis	Probable fructose-bisphosphate aldolase Fba	0.0253	0.0897	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0011	0.001	0.0005
Schistosoma mansoni	opsin-like receptor	0.0011	0.001	0.0005
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0053	0.0164	0.0159
Echinococcus multilocularis	g protein coupled receptor	0.0011	0.001	0.0005
Echinococcus granulosus	g protein coupled receptor	0.0011	0.001	0.0005
Mycobacterium leprae	Probable fructose bisphosphate aldolase Fba	0.0253	0.0897	1
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0011	0.001	0.001
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0053	0.0164	0.0159
Leishmania major	cytochrome p450-like protein	0.0026	0.0063	1
Schistosoma mansoni	neuropeptide receptor	0.0011	0.001	0.0005
Echinococcus granulosus	insulin receptor	0.0263	0.0936	0.0931
Echinococcus granulosus	neuropeptides capa receptor	0.0011	0.001	0.0005
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0011	0.001	0.0005
Echinococcus granulosus	neuropeptide FF receptor 2	0.0011	0.001	0.0005
Brugia malayi	Heterochromatin protein 1	0.0061	0.0192	0.0187
Onchocerca volvulus		0.0011	0.001	0.0475
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Mycobacterium ulcerans	fructose-bisphosphate aldolase	0.0253	0.0897	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0053	0.0164	0.0159
Schistosoma mansoni	hypothetical protein	0.0017	0.0032	0.0027
Loa Loa (eye worm)	cytochrome P450	0.0017	0.0032	0.0032
Schistosoma mansoni	neuropeptide receptor	0.0011	0.001	0.0005
Brugia malayi	Protein kinase domain containing protein	0.0263	0.0936	0.0931
Onchocerca volvulus		0.0011	0.001	0.0475
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0011	0.001	0.0005
Loa Loa (eye worm)	hypothetical protein	0.001	0.0005	0.0005
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.0011	0.001	0.001
Echinococcus multilocularis	neuropeptide Y receptor	0.0011	0.001	0.0005
Echinococcus granulosus	tm gpcr rhodopsin	0.0011	0.001	0.0005
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0011	0.001	0.0005
Loa Loa (eye worm)	CHromoDomain protein family member	0.0011	0.001	0.001
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0011	0.001	0.0005
Echinococcus multilocularis	serotonin receptor	0.013	0.0448	0.0443
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0011	0.001	0.001
Schistosoma mansoni	opsin-like receptor	0.0011	0.001	0.0005
Brugia malayi	RE15519p	0.0011	0.001	0.0005
Giardia lamblia	Fructose-bisphosphate aldolase	0.0517	0.1869	0.5
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Echinococcus granulosus	chromodomain helicase DNA binding protein 4	0.0011	0.001	0.0005
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Echinococcus multilocularis	alpha 1,6 mannosyl glycoprotein	0.2729	1	1
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0011	0.001	0.0005
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0517	0.1869	1
Schistosoma mansoni	hypothetical protein	0.0011	0.001	0.0005
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Echinococcus granulosus	g protein coupled receptor	0.0011	0.001	0.0005
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0011	0.001	0.0005
Loa Loa (eye worm)	hypothetical protein	0.0143	0.0494	0.0494
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Brugia malayi	Serotonin receptor	0.0011	0.001	0.0005
Echinococcus multilocularis	chromobox protein 1	0.0061	0.0192	0.0187
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0016	0.0026	0.0112
Brugia malayi	neuropeptide F receptor	0.0011	0.001	0.0005
Brugia malayi	GnHR receptor homolog	0.0011	0.001	0.0005
Plasmodium vivax	heterochromatin protein 1, putative	0.001	0.0005	0.5
Schistosoma mansoni	neuropeptide receptor	0.0011	0.001	0.0005
Plasmodium vivax	hypothetical protein, conserved	0.001	0.0005	0.5
Echinococcus granulosus	somatostatin receptor	0.0011	0.001	0.0005
Onchocerca volvulus		0.001	0.0007	0.0205
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Loa Loa (eye worm)	CYP4Cod1	0.0026	0.0063	0.0063
Trichomonas vaginalis	chromobox protein, putative	0.0061	0.0192	0.1001
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Loa Loa (eye worm)	heterochromatin protein 1	0.0061	0.0192	0.0192
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0013	0.0016	0.006
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0011	0.001	0.0005
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Schistosoma mansoni	neuropeptide receptor	0.0011	0.001	0.0005
Echinococcus granulosus	cpg binding protein	0.0026	0.0066	0.0061
Onchocerca volvulus		0.0011	0.001	0.0475
Echinococcus granulosus	dro:myosuppressin receptor	0.0011	0.001	0.0005
Loa Loa (eye worm)	TK/FAK protein kinase	0.0251	0.0891	0.0891
Brugia malayi	Dopamine receptor	0.0011	0.001	0.0005
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0011	0.001	0.0005
Brugia malayi	hypothetical protein	0.0011	0.001	0.0005
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0011	0.001	0.0005
Loa Loa (eye worm)	hypothetical protein	0.001	0.0005	0.0005
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Loa Loa (eye worm)	neuropeptide F receptor	0.0011	0.001	0.001
Echinococcus granulosus	serotonin receptor	0.0011	0.001	0.0005
Echinococcus multilocularis	protein tyrosine kinase	0.0248	0.0881	0.0876
Trichomonas vaginalis	conserved hypothetical protein	0.0034	0.0094	0.0475
Brugia malayi	G protein-coupled receptor F59B2.13	0.0011	0.001	0.0005
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0517	0.1869	1
Echinococcus granulosus	sex peptide receptor	0.0011	0.001	0.0005
Schistosoma mansoni	adenoreceptor	0.0011	0.001	0.0005
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0016	0.0026	0.0112
Echinococcus multilocularis	neuropeptide receptor A26	0.0011	0.001	0.0005
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Onchocerca volvulus		0.0011	0.001	0.0475
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0011	0.001	0.0005
Brugia malayi	CHD4 protein	0.0011	0.001	0.0005
Onchocerca volvulus		0.0011	0.001	0.0475
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0011	0.001	0.0005
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0517	0.1869	1
Echinococcus multilocularis	sex peptide receptor	0.0011	0.001	0.0005
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0011	0.001	0.0005
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0011	0.001	0.0005
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0011	0.001	0.0005
Schistosoma mansoni	hypothetical protein	0.0011	0.001	0.0005
Echinococcus granulosus	neuropeptide receptor	0.0011	0.001	0.0005
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0011	0.001	0.0005
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0011	0.001	0.0005
Schistosoma mansoni	amine GPCR	0.0011	0.001	0.0005
Brugia malayi	AKH receptor	0.0011	0.001	0.0005
Toxoplasma gondii	cytochrome p450 superfamily protein	0.0017	0.0032	0.1946
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0011	0.001	0.0005
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0011	0.001	0.0005
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0011	0.001	0.0005
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Brugia malayi	chromobox protein homolog 3	0.0034	0.0094	0.0089
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Plasmodium falciparum	heterochromatin protein 1	0.001	0.0005	0.5
Brugia malayi	CXXC zinc finger family protein	0.0025	0.0061	0.0055
Onchocerca volvulus		0.0011	0.001	0.0475
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Brugia malayi	hypothetical protein	0.0011	0.001	0.0005
Brugia malayi	hypothetical protein	0.0011	0.001	0.0005
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0011	0.001	0.0005
Echinococcus multilocularis	g-protein coupled receptor	0.0011	0.001	0.0005
Brugia malayi	putative neuropeptide receptor NPR1	0.0011	0.001	0.0005
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Schistosoma mansoni	tyrosine kinase	0.0117	0.0399	0.0394
Loa Loa (eye worm)	hypothetical protein	0.013	0.0448	0.0448
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0517	0.1869	1
Echinococcus granulosus	fmrfamide receptor	0.0011	0.001	0.0005
Loa Loa (eye worm)	hypothetical protein	0.001	0.0005	0.0005
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0013	0.0015	0.0052
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0011	0.001	0.001
Trichomonas vaginalis	chromobox protein, putative	0.0037	0.0103	0.0526
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0053	0.0164	0.0159
Echinococcus granulosus	biogenic amine 5HT receptor	0.013	0.0448	0.0443
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0053	0.0164	0.0159
Mycobacterium ulcerans	cytochrome P450 185A4 Cyp185A4	0.0026	0.0063	0.0362
Schistosoma mansoni	hypothetical protein	0.0011	0.001	0.0005
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0016	0.0026	0.0112
Brugia malayi	ORL1-like opioid receptor	0.0011	0.001	0.0005
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0094	0.0094
Echinococcus granulosus	insulin growth factor 1 receptor beta	0.0263	0.0936	0.0931
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Trichomonas vaginalis	conserved hypothetical protein	0.0034	0.0094	0.0475
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0011	0.001	0.0005
Echinococcus granulosus	epidermal growth factor receptor	0.012	0.0411	0.0406
Onchocerca volvulus	Heterochromatin protein 1 homolog	0.0034	0.0094	0.9031
Schistosoma mansoni	chromodomain helicase DNA binding protein	0.0011	0.001	0.0005
Echinococcus multilocularis	neuropeptide s receptor	0.0011	0.001	0.0005
Schistosoma mansoni	myosin xvIII	0.0011	0.001	0.0005
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0016	0.0026	0.0112
Onchocerca volvulus		0.0011	0.001	0.0475
Echinococcus granulosus	biogenic amine 5HT receptor	0.0011	0.001	0.0005
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.001	0.0007	0.0002
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0016	0.0026	0.0112
Schistosoma mansoni	histamine h1 receptor	0.0011	0.001	0.0005
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0011	0.001	0.0005
Schistosoma mansoni	growth hormone secretagogue receptor	0.0011	0.001	0.0005
Schistosoma mansoni	tyrosine kinase	0.0117	0.0399	0.0394
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Echinococcus multilocularis		0.0034	0.0095	0.0089
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Loa Loa (eye worm)	cytochrome P450 family protein	0.0026	0.0063	0.0063
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0517	0.1869	1
Echinococcus multilocularis	insulin growth factor 1 receptor beta	0.0263	0.0936	0.0931
Onchocerca volvulus		0.0027	0.0067	0.6276
Onchocerca volvulus		0.0011	0.001	0.0475
Echinococcus multilocularis	neuropeptide receptor	0.0011	0.001	0.0005
Schistosoma mansoni	cpg binding protein	0.0026	0.0066	0.0061
Brugia malayi	SET domain containing protein	0.001	0.0007	0.0002
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Onchocerca volvulus	Heterochromatin protein 1 homolog	0.0037	0.0103	1
Plasmodium vivax	hypothetical protein, conserved	0.001	0.0005	0.5
Echinococcus multilocularis	somatostatin receptor	0.0011	0.001	0.0005
Schistosoma mansoni	neuropeptide f receptor 76f	0.0011	0.001	0.0005
Echinococcus multilocularis	serotonin receptor	0.013	0.0448	0.0443
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0011	0.001	0.0005
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0011	0.001	0.0005
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0011	0.001	0.0005
Brugia malayi	hypothetical protein	0.0011	0.001	0.0005
Echinococcus multilocularis	orexin receptor type 2	0.0011	0.001	0.0005
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0016	0.0026	0.0112
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0011	0.001	0.0005
Echinococcus granulosus	rhodopsin orphan GPCR	0.0011	0.001	0.0005
Schistosoma mansoni	tyrosine kinase	0.0263	0.0936	0.0931
Trichomonas vaginalis	conserved hypothetical protein	0.0024	0.0057	0.0279
Loa Loa (eye worm)	hypothetical protein	0.013	0.0448	0.0448
Brugia malayi	neuropeptide F receptor	0.0011	0.001	0.0005
Echinococcus granulosus	neuropeptide receptor	0.0011	0.001	0.0005
Brugia malayi	hypothetical protein	0.0011	0.001	0.0005
Echinococcus granulosus	neuropeptide receptor A26	0.0011	0.001	0.0005
Echinococcus granulosus	rhodopsin orphan GPCR	0.0011	0.001	0.0005
Onchocerca volvulus		0.0011	0.001	0.0475
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0011	0.001	0.0005
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0011	0.001	0.0005
Schistosoma mansoni	cytochrome P450	0.0017	0.0032	0.0027
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0011	0.001	0.0005
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0011	0.001	0.0005
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0053	0.0164	0.0159
Schistosoma mansoni	tyrosine kinase	0.012	0.0411	0.0406
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0053	0.0164	0.0164
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Echinococcus granulosus	chromobox protein 1	0.0061	0.0192	0.0187
Loa Loa (eye worm)	TK/INSR protein kinase	0.0263	0.0936	0.0936
Echinococcus granulosus	neuropeptide Y receptor	0.0011	0.001	0.0005
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Echinococcus granulosus	g-protein coupled receptor	0.0011	0.001	0.0005
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0011	0.001	0.0005
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0011	0.001	0.0005
Echinococcus multilocularis	neuropeptide Y receptor	0.0011	0.001	0.0005
Echinococcus granulosus	G protein coupled receptor 139	0.0011	0.001	0.0005
Loa Loa (eye worm)	neuropeptide F receptor	0.0011	0.001	0.001
Echinococcus multilocularis	G protein coupled receptor 139	0.0011	0.001	0.0005
Loa Loa (eye worm)	cytochrome P450 family protein	0.0026	0.0063	0.0063
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0011	0.001	0.0005
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0011	0.001	0.0005
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Loa Loa (eye worm)	G-protein coupled receptor	0.0011	0.001	0.001
Onchocerca volvulus	Neuropeptide F receptor homolog	0.0011	0.001	0.0475
Trichomonas vaginalis	conserved hypothetical protein	0.0024	0.0057	0.0279
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0011	0.001	0.0005
Echinococcus granulosus	rhodopsin orphan GPCR	0.0011	0.001	0.0005
Echinococcus multilocularis	g protein coupled receptor	0.0011	0.001	0.0005
Onchocerca volvulus		0.0011	0.001	0.0475
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0011	0.001	0.0005
Echinococcus granulosus	7tm_1 domain containing protein	0.0011	0.001	0.0005
Brugia malayi	Melatonin receptor type 1A	0.0011	0.001	0.0005
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0517	0.1869	1
Echinococcus granulosus	epidermal growth factor receptor	0.012	0.0411	0.0406
Echinococcus multilocularis	chromodomain helicase DNA binding protein 4	0.0011	0.001	0.0005
Brugia malayi	follicle stimulating hormone receptor	0.0011	0.001	0.0005
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0067	0.0067
Brugia malayi	Protein kinase domain containing protein	0.0251	0.0891	0.0887
Schistosoma mansoni	amine GPCR	0.0011	0.001	0.0005
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Schistosoma mansoni	biogenic amine receptor	0.0011	0.001	0.0005
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0047	0.0143	1
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0016	0.0026	0.0112
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0011	0.001	0.0005
Onchocerca volvulus		0.0011	0.001	0.0475
Loa Loa (eye worm)	hypothetical protein	0.001	0.0005	0.0005
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Plasmodium falciparum	chromodomain-helicase-DNA-binding protein 1 homolog, putative	0.001	0.0005	0.5
Echinococcus multilocularis	epidermal growth factor receptor	0.012	0.0411	0.0406
Brugia malayi	hypothetical protein	0.0011	0.001	0.0005
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0011	0.001	0.0005
Echinococcus granulosus	alpha 16 mannosyl glycoprotein	0.2729	1	1
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0011	0.001	0.0005
Loa Loa (eye worm)	TK/EGFR protein kinase	0.012	0.0411	0.0411
Brugia malayi	Dopamine receptor protein 1	0.0011	0.001	0.0005
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0025	0.0061	0.0061
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Echinococcus multilocularis	insulin receptor	0.0263	0.0936	0.0931
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0011	0.001	0.0005
Echinococcus granulosus	7TM GPCR rhodopsin	0.0011	0.001	0.0005
Brugia malayi	Cytochrome P450 family protein	0.0017	0.0032	0.0027
Schistosoma mansoni	hypothetical protein	0.0011	0.001	0.0005
Onchocerca volvulus		0.0011	0.001	0.0475
Schistosoma mansoni	neuropeptide F-like receptor	0.0011	0.001	0.0005
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0011	0.001	0.0005
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0011	0.001	0.0005
Brugia malayi	G-protein coupled receptor	0.0011	0.001	0.0005
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Echinococcus granulosus	rhodopsin orphan GPCR	0.0011	0.001	0.0005
Echinococcus multilocularis	neuropeptide receptor	0.0011	0.001	0.0005
Schistosoma mansoni	amine GPCR	0.0011	0.001	0.0005
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Trypanosoma cruzi	cytochrome P450, putative	0.0026	0.0063	1
Echinococcus multilocularis		0.0017	0.0032	0.0027
Brugia malayi	Cytochrome P450 family protein	0.0026	0.0063	0.0058
Trichomonas vaginalis	conserved hypothetical protein	0.0013	0.0016	0.006
Echinococcus multilocularis	fmrfamide receptor	0.0011	0.001	0.0005
Brugia malayi	Cytochrome P450 family protein	0.0054	0.0168	0.0163
Echinococcus granulosus	protein tyrosine kinase	0.0248	0.0881	0.0876
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0517	0.1869	1
Brugia malayi	larval opioid receptor	0.0011	0.001	0.0005
Brugia malayi	Dopamine receptor protein 2	0.0011	0.001	0.0005
Brugia malayi	Furin-like cysteine rich region family protein	0.012	0.0411	0.0406
Loa Loa (eye worm)	hypothetical protein	0.001	0.0005	0.0005
Loa Loa (eye worm)	helicase	0.001	0.0005	0.0005
Onchocerca volvulus	Dopamine\/Ecdysteroid receptor homolog	0.0011	0.001	0.0475
Brugia malayi	Cytochrome P450 family protein	0.0026	0.0063	0.0058
Echinococcus granulosus	rhodopsin orphan GPCR	0.0011	0.001	0.0005
Loa Loa (eye worm)	cytochrome P450 family protein	0.0054	0.0168	0.0168
Plasmodium falciparum	conserved Plasmodium protein, unknown function	0.001	0.0005	0.5
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0011	0.001	0.0005
Schistosoma mansoni	cpg binding protein	0.0026	0.0066	0.0061
Brugia malayi	hypothetical protein	0.0011	0.001	0.0005
Brugia malayi	G-protein coupled receptor	0.0011	0.001	0.0005
Onchocerca volvulus		0.0011	0.001	0.0475
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0011	0.001	0.0005
Echinococcus multilocularis	allatostatin A receptor	0.0011	0.001	0.0005
Trypanosoma brucei	cytochrome P450, putative	0.0026	0.0063	1
Schistosoma mansoni	biogenic amine receptor	0.0011	0.001	0.0005
Brugia malayi	hypothetical protein	0.0011	0.001	0.0005
Echinococcus granulosus	melanoma receptor tyrosine protein kinase	0.012	0.0411	0.0406
Echinococcus granulosus	neuropeptide s receptor	0.0011	0.001	0.0005
Echinococcus granulosus	hypothetical protein	0.0011	0.001	0.0005
Schistosoma mansoni	biogenic amine (5HT) receptor	0.013	0.0448	0.0443
Echinococcus multilocularis	dro:myosuppressin receptor	0.0011	0.001	0.0005
Loa Loa (eye worm)	hypothetical protein	0.001	0.0005	0.0005
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0011	0.001	0.0005
Brugia malayi	Serotonin receptor	0.0011	0.001	0.0005
Echinococcus granulosus	neuropeptide Y receptor	0.0011	0.001	0.0005
Loa Loa (eye worm)	melatonin receptor type 1A	0.0011	0.001	0.001
Brugia malayi	Protein kinase domain containing protein	0.0146	0.0505	0.05
Schistosoma mansoni	beta-12-n-acetylglucosaminyltransferase II	0.2729	1	1
Onchocerca volvulus		0.0011	0.001	0.0475
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0011	0.001	0.0005
Echinococcus granulosus	g protein coupled receptor	0.0011	0.001	0.0005
Trichomonas vaginalis	chromobox protein, putative	0.0061	0.0192	0.1001
Echinococcus granulosus	tm gpcr rhodopsin	0.0011	0.001	0.0005
Echinococcus granulosus	cytochrome P450 2K1	0.0017	0.0032	0.0027
Brugia malayi	cytochrome P450	0.0017	0.0032	0.0027
Schistosoma mansoni	tyrosine kinase	0.0263	0.0936	0.0931
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0011	0.001	0.0005
Brugia malayi	G protein-coupled receptor	0.0011	0.001	0.0005
Onchocerca volvulus		0.0011	0.001	0.0475
Echinococcus multilocularis	chromobox protein 1	0.0061	0.0192	0.0187
Schistosoma mansoni	chromobox protein	0.0061	0.0192	0.0187
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0517	0.1869	1
Schistosoma mansoni	amine GPCR	0.0011	0.001	0.0005
Brugia malayi	putative neuropeptide receptor	0.0011	0.001	0.0005
Onchocerca volvulus		0.0025	0.0061	0.5656
Schistosoma mansoni	tyrosine kinase	0.012	0.0411	0.0406
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0011	0.001	0.0005
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0016	0.0026	0.0112
Schistosoma mansoni	cpg binding protein	0.0025	0.0061	0.0055
Brugia malayi	sulfakinin receptor protein	0.0011	0.001	0.0005
Loa Loa (eye worm)	TYRA-2 protein	0.0011	0.001	0.001
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0011	0.001	0.0005
Echinococcus granulosus	chromobox protein 1	0.0061	0.0192	0.0187
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Echinococcus granulosus	orexin receptor type 2	0.0011	0.001	0.0005
Schistosoma mansoni	biogenic amine receptor	0.0011	0.001	0.0005
Schistosoma mansoni	opsin-like receptor	0.0011	0.001	0.0005
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0053	0.0164	0.0159
Echinococcus granulosus	rhodopsin orphan GPCR	0.0011	0.001	0.0005
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0053	0.0164	0.0159
Onchocerca volvulus		0.0011	0.001	0.0475
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0011	0.001	0.0005
Echinococcus granulosus	tm gpcr rhodopsin	0.0011	0.001	0.0005
Echinococcus multilocularis	epidermal growth factor receptor	0.012	0.0411	0.0406
Loa Loa (eye worm)	hypothetical protein	0.2729	1	1
Loa Loa (eye worm)	hypothetical protein	0.0011	0.001	0.001
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0517	0.1869	1
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0011	0.001	0.0005
Trypanosoma cruzi	cytochrome P450, putative	0.0026	0.0063	1
Echinococcus multilocularis	neuropeptides capa receptor	0.0011	0.001	0.0005
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0011	0.001	0.0005
Loa Loa (eye worm)	G-protein coupled receptor	0.0011	0.001	0.001
Schistosoma mansoni	neuropeptide F-like receptor	0.0011	0.001	0.0005
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0011	0.001	0.0005
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0011	0.001	0.0005
Echinococcus granulosus	rhodopsin orphan GPCR	0.0011	0.001	0.0005
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0517	0.1869	1
Echinococcus multilocularis	g protein coupled receptor	0.0011	0.001	0.0005

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	3.6537 uM	PUBCHEM_BIOASSAY: qHTS of small molecules that selectively kill Giardia lamblia: Hit Validation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID540272]	ChEMBL.	No reference
Potency (functional)	63.0957 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of mutant isocitrate dehydrogenase 1 (IDH1): qHTS. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	125.8925 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Rango (Ran-regulated importin-beta cargo) - Importin beta complex formation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID540273]	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Giardia lamblia

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: CHEMBL1906008

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1536827