TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 567.994 | Formula: C29H28ClN2O8-
H donors: 2 H acceptors: 4 LogP: 3.23 Rotable bonds: 8
Rule of 5 violations (Lipinski): 2
SMILES: COc1cc(cc(c1O)OC)[C@@H]1[C@@H]2C(=O)OCC2[C@H](c2c1cc1OCOc1c2)CC(=O)NCc1ccncc1.[Cl-]
InChi: 1S/C29H28N2O8.ClH/c1-35-23-7-16(8-24(36-2)28(23)33)26-19-10-22-21(38-14-39-22)9-17(19)18(20-13-37-29(34)27(20)26)11-25(32)31-12-15-3-5-30-6-4-15;/h3-10,18,20,26-27,33H,11-14H2,1-2H3,(H,31,32);1H/p-1/t18-,20?,26-,27+;/m1./s1
InChiKey: ZVZYIQLMYQACOH-GBRTXJOBSA-M

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	rhodopsin orphan GPCR	0.0042	0.0216	0.0284
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Echinococcus granulosus	g protein coupled receptor	0.0042	0.0216	0.0284
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Leishmania major	6-phosphofructo-2-kinase/fructose-2,6-biphosphatase, putative	0.0559	0.4287	1
Leishmania major	6-phosphofructo-2-kinase/fructose-2,6-biphosphatase, putative	0.055	0.4213	0.9706
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Schistosoma mansoni	hypothetical protein	0.0042	0.0216	0.0284
Echinococcus multilocularis	6 phosphofructo 2 kinase:fructose 2	0.0559	0.4287	1
Brugia malayi	Dopamine receptor	0.0042	0.0216	0.0216
Onchocerca volvulus		0.0042	0.0216	0.0284
Echinococcus multilocularis	serotonin receptor	0.0042	0.0216	0.0284
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Mycobacterium ulcerans	hypothetical protein	0.033	0.2484	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0042	0.0216	0.0284
Echinococcus multilocularis	somatostatin receptor	0.0042	0.0216	0.0284
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0042	0.0216	0.0284
Echinococcus granulosus	g-protein coupled receptor	0.0042	0.0216	0.0284
Loa Loa (eye worm)	glutaminase 2	0.027	0.2015	0.2015
Echinococcus granulosus	sex peptide receptor	0.0042	0.0216	0.0284
Brugia malayi	hypothetical protein	0.0042	0.0216	0.0216
Echinococcus granulosus	g protein coupled receptor	0.0042	0.0216	0.0284
Brugia malayi	G-protein coupled receptor	0.0042	0.0216	0.0216
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0042	0.0216	0.0284
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0042	0.0216	0.0284
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Brugia malayi	Serotonin receptor	0.0042	0.0216	0.0216
Schistosoma mansoni	biogenic amine receptor	0.0042	0.0216	0.0284
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0042	0.0216	0.0284
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0042	0.0216	0.0284
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0042	0.0216	0.0284
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0042	0.0216	0.0284
Echinococcus granulosus	tm gpcr rhodopsin	0.0042	0.0216	0.0284
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Echinococcus multilocularis	neuropeptide Y receptor	0.0042	0.0216	0.0284
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0042	0.0216	0.0216
Schistosoma mansoni	glutaminase	0.027	0.2015	0.4576
Schistosoma mansoni	amine GPCR	0.0042	0.0216	0.0284
Brugia malayi	Pre-SET motif family protein	0.0225	0.1658	0.1658
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0032	0.0141	0.0105
Giardia lamblia	Hypothetical protein	0.033	0.2484	0.5
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0042	0.0216	0.0216
Brugia malayi	ORL1-like opioid receptor	0.0042	0.0216	0.0216
Brugia malayi	intermediate filament protein	0.0027	0.0097	0.0097
Onchocerca volvulus		0.0042	0.0216	0.0284
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Brugia malayi	hypothetical protein	0.0042	0.0216	0.0216
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0042	0.0216	0.0284
Giardia lamblia	Hypothetical protein	0.033	0.2484	0.5
Echinococcus granulosus	somatostatin receptor	0.0042	0.0216	0.0284
Brugia malayi	Melatonin receptor type 1A	0.0042	0.0216	0.0216
Echinococcus multilocularis	neuropeptide Y receptor	0.0042	0.0216	0.0284
Echinococcus granulosus	rhodopsin orphan GPCR	0.0042	0.0216	0.0284
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0042	0.0216	0.0284
Brugia malayi	hypothetical protein	0.0042	0.0216	0.0216
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0032	0.0141	0.0105
Schistosoma mansoni	biogenic amine receptor	0.0042	0.0216	0.0284
Onchocerca volvulus		0.0042	0.0216	0.0284
Brugia malayi	neuropeptide F receptor	0.0042	0.0216	0.0216
Onchocerca volvulus		0.0042	0.0216	0.0284
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0042	0.0216	0.0284
Onchocerca volvulus		0.0042	0.0216	0.0284
Plasmodium vivax	SET domain protein, putative	0.0032	0.0141	0.5
Onchocerca volvulus		0.0042	0.0216	0.0284
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0042	0.0216	0.0284
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0042	0.0216	0.0284
Brugia malayi	AKH receptor	0.0042	0.0216	0.0216
Schistosoma mansoni	biogenic amine receptor	0.0042	0.0216	0.0284
Onchocerca volvulus		0.0042	0.0216	0.0284
Trypanosoma cruzi	6-phosphofructo-2-kinase 1	0.055	0.4213	0.9706
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0042	0.0216	0.0216
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Trypanosoma brucei	6-phosphofructo-2-kinase 2	0.055	0.4213	0.9706
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Echinococcus multilocularis	geminin	0.0168	0.1206	0.2646
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0042	0.0216	0.0284
Loa Loa (eye worm)	hypothetical protein	0.0321	0.241	0.241
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0042	0.0216	0.0284
Echinococcus granulosus	geminin	0.0168	0.1206	0.2646
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0042	0.0216	0.0216
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0042	0.0216	0.0284
Loa Loa (eye worm)	hypothetical protein	0.0559	0.4287	0.4287
Echinococcus granulosus	g protein coupled receptor	0.0042	0.0216	0.0284
Brugia malayi	GnHR receptor homolog	0.0042	0.0216	0.0216
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0042	0.0216	0.0284
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0141	0.0141
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Echinococcus granulosus	dro:myosuppressin receptor	0.0042	0.0216	0.0284
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0097	0.0097
Echinococcus multilocularis	g protein coupled receptor	0.0042	0.0216	0.0284
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Onchocerca volvulus		0.0559	0.4287	1
Echinococcus granulosus	neuropeptides capa receptor	0.0042	0.0216	0.0284
Echinococcus granulosus	tm gpcr rhodopsin	0.0042	0.0216	0.0284
Onchocerca volvulus		0.0042	0.0216	0.0284
Schistosoma mansoni	neuropeptide receptor	0.0042	0.0216	0.0284
Onchocerca volvulus		0.0042	0.0216	0.0284
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0042	0.0216	0.0284
Brugia malayi	Serotonin receptor	0.0042	0.0216	0.0216
Loa Loa (eye worm)	hypothetical protein	0.055	0.4213	0.4213
Onchocerca volvulus	Neuropeptide F receptor homolog	0.0042	0.0216	0.0284
Echinococcus granulosus	neuropeptide s receptor	0.0042	0.0216	0.0284
Echinococcus multilocularis	G protein coupled receptor 139	0.0042	0.0216	0.0284
Schistosoma mansoni	neuropeptide F-like receptor	0.0042	0.0216	0.0284
Onchocerca volvulus		0.0042	0.0216	0.0284
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0042	0.0216	0.0284
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Echinococcus multilocularis	neuropeptide receptor	0.0042	0.0216	0.0284
Loa Loa (eye worm)	hypothetical protein	0.1285	1	1
Onchocerca volvulus	Dopamine\/Ecdysteroid receptor homolog	0.0042	0.0216	0.0284
Brugia malayi	glutaminase DH11.1	0.027	0.2015	0.2015
Echinococcus granulosus	neuropeptide FF receptor 2	0.0042	0.0216	0.0284
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0042	0.0216	0.0284
Echinococcus granulosus	neuropeptide receptor A26	0.0042	0.0216	0.0284
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Brugia malayi	follicle stimulating hormone receptor	0.0042	0.0216	0.0216
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0032	0.0141	0.5
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0225	0.1658	0.1658
Echinococcus granulosus	G protein coupled receptor 139	0.0042	0.0216	0.0284
Echinococcus multilocularis	fmrfamide receptor	0.0042	0.0216	0.0284
Brugia malayi	hypothetical protein	0.0042	0.0216	0.0216
Schistosoma mansoni	amine GPCR	0.0042	0.0216	0.0284
Echinococcus granulosus	rhodopsin orphan GPCR	0.0042	0.0216	0.0284
Brugia malayi	hypothetical protein	0.0042	0.0216	0.0216
Schistosoma mansoni	6-phosphofructokinase	0.0559	0.4287	1
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Brugia malayi	G-protein coupled receptor	0.0042	0.0216	0.0216
Echinococcus multilocularis	neuropeptide receptor	0.0042	0.0216	0.0284
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Loa Loa (eye worm)	G-protein coupled receptor	0.0042	0.0216	0.0216
Onchocerca volvulus		0.0042	0.0216	0.0284
Brugia malayi	RE15519p	0.0042	0.0216	0.0216
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0042	0.0216	0.0284
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0042	0.0216	0.0216
Echinococcus multilocularis	neuropeptides capa receptor	0.0042	0.0216	0.0284
Entamoeba histolytica	phosphoglycerate mutase family protein, putative	0.033	0.2484	0.5
Trypanosoma cruzi	6-phosphofructo-2-kinase/fructose-2,6-biphosphatase, putative	0.0559	0.4287	1
Onchocerca volvulus		0.0256	0.1902	0.4307
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0042	0.0216	0.0284
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0042	0.0216	0.0284
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0042	0.0216	0.0284
Loa Loa (eye worm)	glutaminase	0.027	0.2015	0.2015
Loa Loa (eye worm)	G-protein coupled receptor	0.0042	0.0216	0.0216
Echinococcus granulosus	biogenic amine 5HT receptor	0.0042	0.0216	0.0284
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0042	0.0216	0.0284
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0042	0.0216	0.0284
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Schistosoma mansoni	neuropeptide F-like receptor	0.0042	0.0216	0.0284
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0042	0.0216	0.0284
Brugia malayi	Dopamine receptor protein 1	0.0042	0.0216	0.0216
Schistosoma mansoni	hypothetical protein	0.0042	0.0216	0.0284
Echinococcus multilocularis	neuropeptide s receptor	0.0042	0.0216	0.0284
Echinococcus multilocularis	allatostatin A receptor	0.0042	0.0216	0.0284
Schistosoma mansoni	neuropeptide receptor	0.0042	0.0216	0.0284
Echinococcus granulosus	neuropeptide receptor	0.0042	0.0216	0.0284
Schistosoma mansoni	hypothetical protein	0.0042	0.0216	0.0284
Schistosoma mansoni	neuropeptide f receptor 76f	0.0042	0.0216	0.0284
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0042	0.0216	0.0284
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0042	0.0216	0.0284
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0042	0.0216	0.0284
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0042	0.0216	0.0284
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0042	0.0216	0.0216
Echinococcus multilocularis	serotonin receptor	0.0042	0.0216	0.0284
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0032	0.0141	0.0105
Schistosoma mansoni	hypothetical protein	0.0042	0.0216	0.0284
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0042	0.0216	0.0284
Loa Loa (eye worm)	TYRA-2 protein	0.0042	0.0216	0.0216
Schistosoma mansoni	amine GPCR	0.0042	0.0216	0.0284
Echinococcus multilocularis	fmrfamide receptor	0.0042	0.0216	0.0284
Mycobacterium ulcerans	fructose-2,6-bisphosphatase GpmB	0.033	0.2484	1
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Onchocerca volvulus		0.0042	0.0216	0.0284
Brugia malayi	G protein-coupled receptor F59B2.13	0.0042	0.0216	0.0216
Echinococcus granulosus	7TM GPCR rhodopsin	0.0042	0.0216	0.0284
Trichomonas vaginalis	glutaminase, putative	0.027	0.2015	1
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0042	0.0216	0.0216
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0042	0.0216	0.0284
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0042	0.0216	0.0284
Onchocerca volvulus		0.0042	0.0216	0.0284
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Echinococcus multilocularis	neuropeptide receptor A26	0.0042	0.0216	0.0284
Onchocerca volvulus		0.0042	0.0216	0.0284
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0042	0.0216	0.0284
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0042	0.0216	0.0284
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0042	0.0216	0.0284
Brugia malayi	hypothetical protein	0.0042	0.0216	0.0216
Schistosoma mansoni	amine GPCR	0.0042	0.0216	0.0284
Onchocerca volvulus		0.0032	0.0141	0.0105
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Trypanosoma cruzi	6-phosphofructo-2-kinase 1	0.055	0.4213	0.9706
Echinococcus granulosus	rhodopsin orphan GPCR	0.0042	0.0216	0.0284
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0042	0.0216	0.0284
Schistosoma mansoni	hypothetical protein	0.0168	0.1206	0.2646
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0042	0.0216	0.0216
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Brugia malayi	Dopamine receptor protein 2	0.0042	0.0216	0.0216
Echinococcus granulosus	fmrfamide receptor	0.0042	0.0216	0.0284
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0031	0.0132	0.0083
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0042	0.0216	0.0216
Schistosoma mansoni	adenoreceptor	0.0042	0.0216	0.0284
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0042	0.0216	0.0284
Echinococcus granulosus	7tm_1 domain containing protein	0.0042	0.0216	0.0284
Brugia malayi	Pre-SET motif family protein	0.0032	0.0141	0.0141
Echinococcus granulosus	tm gpcr rhodopsin	0.0042	0.0216	0.0284
Loa Loa (eye worm)	neuropeptide F receptor	0.0042	0.0216	0.0216
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Echinococcus multilocularis	neuropeptides capa receptor	0.0042	0.0216	0.0284
Schistosoma mansoni	hypothetical protein	0.0168	0.1206	0.2646
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0042	0.0216	0.0284
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Brugia malayi	putative neuropeptide receptor	0.0042	0.0216	0.0216
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0042	0.0216	0.0284
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.0042	0.0216	0.0216
Schistosoma mansoni	myosin xvIII	0.0042	0.0216	0.0284
Schistosoma mansoni	opsin-like receptor	0.0042	0.0216	0.0284
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0032	0.0141	0.0105
Echinococcus granulosus	hypothetical protein	0.0042	0.0216	0.0284
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0042	0.0216	0.0284
Loa Loa (eye worm)	neuropeptide F receptor	0.0042	0.0216	0.0216
Echinococcus multilocularis	orexin receptor type 2	0.0042	0.0216	0.0284
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0027	0.0097	0.0097
Echinococcus granulosus	rhodopsin orphan GPCR	0.0042	0.0216	0.0284
Echinococcus granulosus	neuropeptide Y receptor	0.0042	0.0216	0.0284
Brugia malayi	neuropeptide F receptor	0.0042	0.0216	0.0216
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0042	0.0216	0.0284
Brugia malayi	hypothetical protein	0.0042	0.0216	0.0216
Echinococcus multilocularis	dro:myosuppressin receptor	0.0042	0.0216	0.0284
Schistosoma mansoni	opsin-like receptor	0.0042	0.0216	0.0284
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0094	0.0094
Echinococcus granulosus	histone lysine methyltransferase setb	0.0032	0.0141	0.0105
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Echinococcus granulosus	neuropeptide receptor	0.0042	0.0216	0.0284
Schistosoma mansoni	amine GPCR	0.0042	0.0216	0.0284
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0042	0.0216	0.0284
Echinococcus granulosus	rhodopsin orphan GPCR	0.0042	0.0216	0.0284
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0042	0.0216	0.0284
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Echinococcus granulosus	orexin receptor type 2	0.0042	0.0216	0.0284
Onchocerca volvulus		0.0042	0.0216	0.0284
Trypanosoma brucei	6-phosphofructo-2-kinase/fructose-2,6-biphosphatase, putative	0.0559	0.4287	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0042	0.0216	0.0284
Echinococcus granulosus	6 phosphofructo 2 kinase:fructose 2	0.0559	0.4287	1
Echinococcus granulosus	allatostatin A receptor	0.0042	0.0216	0.0284
Brugia malayi	hypothetical protein	0.0042	0.0216	0.0216
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0042	0.0216	0.0284
Loa Loa (eye worm)	melatonin receptor type 1A	0.0042	0.0216	0.0216
Echinococcus multilocularis	g-protein coupled receptor	0.0042	0.0216	0.0284
Schistosoma mansoni	neuropeptide receptor	0.0042	0.0216	0.0284
Brugia malayi	putative neuropeptide receptor NPR1	0.0042	0.0216	0.0216
Echinococcus multilocularis	g protein coupled receptor	0.0042	0.0216	0.0284
Schistosoma mansoni	growth hormone secretagogue receptor	0.0042	0.0216	0.0284
Brugia malayi	Intermediate filament tail domain containing protein	0.0027	0.0097	0.0097
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0042	0.0216	0.0284
Schistosoma mansoni	neuropeptide receptor	0.0042	0.0216	0.0284
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Brugia malayi	larval opioid receptor	0.0042	0.0216	0.0216
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Loa Loa (eye worm)	intermediate filament protein	0.0027	0.0097	0.0097
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0042	0.0216	0.0284
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Echinococcus multilocularis	g protein coupled receptor	0.0042	0.0216	0.0284
Echinococcus multilocularis	sex peptide receptor	0.0042	0.0216	0.0284
Echinococcus granulosus	biogenic amine 5HT receptor	0.0042	0.0216	0.0284
Echinococcus granulosus	rhodopsin orphan GPCR	0.0042	0.0216	0.0284
Brugia malayi	G protein-coupled receptor	0.0042	0.0216	0.0216
Echinococcus granulosus	neuropeptides capa receptor	0.0042	0.0216	0.0284
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0032	0.0141	0.0105
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0042	0.0216	0.0284
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0042	0.0216	0.0284
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Brugia malayi	sulfakinin receptor protein	0.1285	1	1
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0216	0.0216
Schistosoma mansoni	opsin-like receptor	0.0042	0.0216	0.0284
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.0042	0.0216	0.0216
Echinococcus granulosus	serotonin receptor	0.0042	0.0216	0.0284
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0032	0.0141	0.0105
Echinococcus granulosus	neuropeptide Y receptor	0.0042	0.0216	0.0284
Brugia malayi	hypothetical protein	0.0042	0.0216	0.0216
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0042	0.0216	0.0284
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0042	0.0216	0.0284
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0042	0.0216	0.0284
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0042	0.0216	0.0284
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0042	0.0216	0.0284
Onchocerca volvulus		0.0042	0.0216	0.0284
Onchocerca volvulus		0.0042	0.0216	0.0284
Trypanosoma cruzi	6-phosphofructo-2-kinase/fructose-2,6-biphosphatase, putative	0.0559	0.4287	1
Schistosoma mansoni	histamine h1 receptor	0.0042	0.0216	0.0284
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0042	0.0216	0.0284
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0042	0.0216	0.0284

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 0.0000022 M	Cytotoxicity against P388 leukemia	ChEMBL.	8389875
IC50 (binding)	0 uM	Inhibition of DNA topoisomerase II from Rat Liver measured as 50% reduction in the amount of minicircle DNA relative to the control; Not tested	ChEMBL.	8389875
IC50 (binding)	> 100 uM	Drug concentration needed to produce a 50% reduction of bovine brain tubulin polymerization relative to the control	ChEMBL.	8389875

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: 169314

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 67084