TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 1021.2 | Formula: C49H80N8O15
H donors: 14 H acceptors: 15 LogP: 1.93 Rotable bonds: 20
Rule of 5 violations (Lipinski): 4
SMILES: CCC(CCCCCCCCCCC(=O)N[C@@H]1C[C@@H](O)C(CN)NC(=O)[C@@H]2[C@@H](O)[C@H](CN2C(=O)C(CO)NC(=O)C(NC(=O)[C@H]2N(C(=O)C(NC1=O)C(O)C)C[C@@H](C2)O)[C@H]([C@@H](c1ccc(cc1)O)O)O)C)C
InChi: 1S/C49H80N8O15/c1-5-26(2)14-12-10-8-6-7-9-11-13-15-37(63)51-32-21-36(62)33(22-50)52-47(70)40-41(64)27(3)23-57(40)48(71)34(25-58)53-46(69)39(43(66)42(65)29-16-18-30(60)19-17-29)55-45(68)35-20-31(61)24-56(35)49(72)38(28(4)59)54-44(32)67/h16-19,26-28,31-36,38-43,58-62,64-66H,5-15,20-25,50H2,1-4H3,(H,51,63)(H,52,70)(H,53,69)(H,54,67)(H,55,68)/t26?,27-,28?,31+,32+,33?,34?,35-,36+,38?,39?,40-,41-,42+,43+/m0/s1
InChiKey: VLJLUHYGNBTPHH-KRLUWFMVSA-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
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0121	0.2496	0.2485
Echinococcus granulosus	tm gpcr rhodopsin	0.0121	0.2496	0.2485
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Echinococcus granulosus	neuropeptides capa receptor	0.0121	0.2496	0.2485
Echinococcus multilocularis	neuropeptide receptor	0.0121	0.2496	0.2485
Schistosoma mansoni	amine GPCR	0.0121	0.2496	0.2485
Echinococcus multilocularis	g-protein coupled receptor	0.0121	0.2496	0.2485
Schistosoma mansoni	neuropeptide F-like receptor	0.0121	0.2496	0.2485
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0	0.5
Echinococcus granulosus	tm gpcr rhodopsin	0.0121	0.2496	0.2485
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0	0.5
Loa Loa (eye worm)	neuropeptide F receptor	0.0121	0.2496	0.8686
Schistosoma mansoni	neuropeptide receptor	0.0121	0.2496	0.2485
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0121	0.2496	0.2485
Echinococcus multilocularis	Ataxin 2, N terminal,domain containing protein	0.0013	0.0119	0.0104
Trypanosoma cruzi	DNA topoisomerase type IB small subunit, putative	0.0035	0.0599	0.0819
Trypanosoma cruzi	DNA topoisomerase IB, large subunit, putative	0.0103	0.2105	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.0121	0.2496	0.2485
Brugia malayi	hypothetical protein	0.0121	0.2496	0.8687
Schistosoma mansoni	opsin-like receptor	0.0121	0.2496	0.2485
Brugia malayi	G-protein coupled receptor	0.0121	0.2496	0.8687
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0121	0.2496	0.2485
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0121	0.2496	0.2485
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Loa Loa (eye worm)	DNA topoisomerase I	0.0138	0.2865	1
Onchocerca volvulus		0.0121	0.2496	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0121	0.2496	0.2485
Echinococcus granulosus	sex peptide receptor	0.0121	0.2496	0.2485
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0121	0.2496	0.2485
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0	0.5
Leishmania major	DNA topoisomerase type IB small subunit	0.0035	0.0599	0.0819
Brugia malayi	GnHR receptor homolog	0.0121	0.2496	0.8687
Toxoplasma gondii	DNA topoisomerase I, putative	0.0138	0.2865	1
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Trypanosoma brucei	DNA topoisomerase IB, large subunit	0.0103	0.2105	1
Echinococcus multilocularis	dnaJ subfamily B	0.0462	1	1
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0121	0.2496	0.2485
Echinococcus multilocularis	DNA topoisomerase 1	0.0138	0.2865	0.2854
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0121	0.2496	0.8686
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Brugia malayi	DNA topoisomerase I	0.0138	0.2865	1
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0121	0.2496	0.2485
Echinococcus granulosus	neuropeptide FF receptor 2	0.0121	0.2496	0.2485
Echinococcus multilocularis	sex peptide receptor	0.0121	0.2496	0.2485
Plasmodium vivax	topoisomerase I, putative	0.0138	0.2865	1
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Brugia malayi	RE15519p	0.0121	0.2496	0.8687
Onchocerca volvulus		0.0121	0.2496	1
Schistosoma mansoni	hypothetical protein	0.0121	0.2496	0.2485
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Echinococcus granulosus	neuropeptide receptor	0.0121	0.2496	0.2485
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0121	0.2496	0.2485
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0465	0.1445
Onchocerca volvulus		0.0121	0.2496	1
Schistosoma mansoni	neuropeptide receptor	0.0121	0.2496	0.2485
Echinococcus granulosus	rhodopsin orphan GPCR	0.0121	0.2496	0.2485
Echinococcus granulosus	tm gpcr rhodopsin	0.0121	0.2496	0.2485
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0121	0.2496	0.2485
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0121	0.2496	0.2485
Echinococcus granulosus	7tm_1 domain containing protein	0.0121	0.2496	0.2485
Plasmodium falciparum	topoisomerase I	0.0138	0.2865	1
Echinococcus granulosus	neuropeptide Y receptor	0.0121	0.2496	0.2485
Echinococcus granulosus	Ataxin 2 N terminaldomain containing protein	0.0013	0.0119	0.0104
Brugia malayi	hypothetical protein	0.0121	0.2496	0.8687
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Echinococcus multilocularis	g protein coupled receptor	0.0121	0.2496	0.2485
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Schistosoma mansoni	cpg binding protein	0.0034	0.0593	0.0578
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0121	0.2496	0.2485
Loa Loa (eye worm)	G-protein coupled receptor	0.0121	0.2496	0.8686
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0121	0.2496	0.2485
Echinococcus granulosus	rhodopsin orphan GPCR	0.0121	0.2496	0.2485
Schistosoma mansoni	biogenic amine receptor	0.0121	0.2496	0.2485
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0069	0.1352	0.1338
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Schistosoma mansoni	amine GPCR	0.0121	0.2496	0.2485
Echinococcus multilocularis	neuropeptides capa receptor	0.0121	0.2496	0.2485
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0	0.5
Echinococcus multilocularis	neuropeptide receptor A26	0.0121	0.2496	0.2485
Onchocerca volvulus	Dopamine\/Ecdysteroid receptor homolog	0.0121	0.2496	1
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.001	0.0059	0.0044
Loa Loa (eye worm)	G-protein coupled receptor	0.0121	0.2496	0.8686
Schistosoma mansoni	hypothetical protein	0.0121	0.2496	0.2485
Echinococcus granulosus	biogenic amine 5HT receptor	0.0121	0.2496	0.2485
Loa Loa (eye worm)	melatonin receptor type 1A	0.0121	0.2496	0.8686
Echinococcus granulosus	rhodopsin orphan GPCR	0.0121	0.2496	0.2485
Onchocerca volvulus		0.0121	0.2496	1
Echinococcus multilocularis	g protein coupled receptor	0.0121	0.2496	0.2485
Schistosoma mansoni	histamine h1 receptor	0.0121	0.2496	0.2485
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0121	0.2496	0.2485
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0121	0.2496	0.2485
Brugia malayi	Serotonin receptor	0.0121	0.2496	0.8687
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0121	0.2496	0.2485
Echinococcus granulosus	7TM GPCR rhodopsin	0.0121	0.2496	0.2485
Schistosoma mansoni	DNA topoisomerase type I	0.0138	0.2865	0.2854
Brugia malayi	hypothetical protein	0.0121	0.2496	0.8687
Brugia malayi	hypothetical protein	0.0121	0.2496	0.8687
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0121	0.2496	0.8687
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0121	0.2496	0.2485
Schistosoma mansoni	cpg binding protein	0.0032	0.0552	0.0537
Schistosoma mansoni	neuropeptide f receptor 76f	0.0121	0.2496	0.2485
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0121	0.2496	0.2485
Brugia malayi	hypothetical protein	0.0121	0.2496	0.8687
Schistosoma mansoni	amine GPCR	0.0121	0.2496	0.2485
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0121	0.2496	0.2485
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0121	0.2496	0.8686
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0121	0.2496	0.2485
Schistosoma mansoni	hypothetical protein	0.0121	0.2496	0.2485
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0007	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Brugia malayi	Serotonin receptor	0.0121	0.2496	0.8687
Echinococcus granulosus	orexin receptor type 2	0.0121	0.2496	0.2485
Echinococcus granulosus	g-protein coupled receptor	0.0121	0.2496	0.2485
Brugia malayi	Dopamine receptor protein 1	0.0121	0.2496	0.8687
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.0121	0.2496	0.8686
Onchocerca volvulus		0.0121	0.2496	1
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0121	0.2496	0.2485
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0121	0.2496	0.2485
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0121	0.2496	0.2485
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Brugia malayi	Dopamine receptor	0.0121	0.2496	0.8687
Onchocerca volvulus		0.0121	0.2496	1
Echinococcus granulosus	somatostatin receptor	0.0121	0.2496	0.2485
Echinococcus multilocularis	orexin receptor type 2	0.0121	0.2496	0.2485
Onchocerca volvulus		0.0121	0.2496	1
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Echinococcus granulosus	hypothetical protein	0.0121	0.2496	0.2485
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0121	0.2496	0.2485
Brugia malayi	neuropeptide F receptor	0.0121	0.2496	0.8687
Echinococcus multilocularis	neuropeptides capa receptor	0.0121	0.2496	0.2485
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0121	0.2496	0.2485
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0121	0.2496	0.2485
Onchocerca volvulus		0.0121	0.2496	1
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0	0.5
Brugia malayi	G-protein coupled receptor	0.0121	0.2496	0.8687
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Echinococcus granulosus	biogenic amine 5HT receptor	0.0121	0.2496	0.2485
Echinococcus granulosus	DNA topoisomerase 1	0.0138	0.2865	0.2854
Brugia malayi	Melatonin receptor type 1A	0.0121	0.2496	0.8687
Echinococcus multilocularis	G protein coupled receptor 139	0.0121	0.2496	0.2485
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0121	0.2496	0.2485
Echinococcus granulosus	rhodopsin orphan GPCR	0.0121	0.2496	0.2485
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.0121	0.2496	0.8686
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0061	0.119	0.3022
Brugia malayi	G protein-coupled receptor F59B2.13	0.0121	0.2496	0.8687
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0121	0.2496	0.8687
Brugia malayi	larval opioid receptor	0.0121	0.2496	0.8687
Trypanosoma brucei	DNA topoisomerase type IB small subunit	0.0035	0.0599	0.0819
Onchocerca volvulus		0.0121	0.2496	1
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0121	0.2496	0.8687
Loa Loa (eye worm)	neuropeptide F receptor	0.0121	0.2496	0.8686
Schistosoma mansoni	myosin xvIII	0.0121	0.2496	0.2485
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0121	0.2496	0.2485
Echinococcus granulosus	neuropeptide receptor A26	0.0121	0.2496	0.2485
Brugia malayi	hypothetical protein	0.0121	0.2496	0.8687
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.001	0.0059	0.0044
Echinococcus granulosus	cpg binding protein	0.0034	0.0593	0.0578
Schistosoma mansoni	cpg binding protein	0.0034	0.0593	0.0578
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0121	0.2496	0.2485
Echinococcus multilocularis	serotonin receptor	0.0121	0.2496	0.2485
Echinococcus multilocularis	fmrfamide receptor	0.0121	0.2496	0.2485
Schistosoma mansoni	neuropeptide receptor	0.0121	0.2496	0.2485
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0121	0.2496	0.8687
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0	0.5
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0121	0.2496	0.2485
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0	0.5
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0121	0.2496	0.2485
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0121	0.2496	0.2485
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0121	0.2496	0.2485
Schistosoma mansoni	neuropeptide receptor	0.0121	0.2496	0.2485
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0121	0.2496	0.8686
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Onchocerca volvulus		0.0121	0.2496	1
Brugia malayi	neuropeptide F receptor	0.0121	0.2496	0.8687
Brugia malayi	ORL1-like opioid receptor	0.0121	0.2496	0.8687
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0	0.5
Echinococcus multilocularis	neuropeptide Y receptor	0.0121	0.2496	0.2485
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0121	0.2496	0.2485
Echinococcus granulosus	rhodopsin orphan GPCR	0.0121	0.2496	0.2485
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0121	0.2496	0.2485
Echinococcus multilocularis	allatostatin A receptor	0.0121	0.2496	0.2485
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0032	0.0552	0.1756
Echinococcus multilocularis	g protein coupled receptor	0.0121	0.2496	0.2485
Brugia malayi	putative neuropeptide receptor NPR1	0.0121	0.2496	0.8687
Echinococcus granulosus	neuropeptide s receptor	0.0121	0.2496	0.2485
Schistosoma mansoni	opsin-like receptor	0.0121	0.2496	0.2485
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0121	0.2496	0.2485
Echinococcus granulosus	dro:myosuppressin receptor	0.0121	0.2496	0.2485
Echinococcus granulosus	allatostatin A receptor	0.0121	0.2496	0.2485
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Onchocerca volvulus	Neuropeptide F receptor homolog	0.0121	0.2496	1
Brugia malayi	Dopamine receptor protein 2	0.0121	0.2496	0.8687
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Brugia malayi	hypothetical protein	0.0018	0.0243	0.0663
Schistosoma mansoni	amine GPCR	0.0121	0.2496	0.2485
Brugia malayi	hypothetical protein	0.0028	0.0465	0.1453
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0121	0.2496	0.2485
Echinococcus multilocularis	dro:myosuppressin receptor	0.0121	0.2496	0.2485
Echinococcus multilocularis	neuropeptide s receptor	0.0121	0.2496	0.2485
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Leishmania major	DNA topoisomerase IB, large subunit	0.0103	0.2105	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.0121	0.2496	0.2485
Schistosoma mansoni	hypothetical protein	0.0462	1	1
Schistosoma mansoni	growth hormone secretagogue receptor	0.0121	0.2496	0.2485
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0121	0.2496	0.2485
Echinococcus granulosus	G protein coupled receptor 139	0.0121	0.2496	0.2485
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Brugia malayi	CXXC zinc finger family protein	0.0032	0.0552	0.1764
Echinococcus granulosus	g protein coupled receptor	0.0121	0.2496	0.2485
Schistosoma mansoni	biogenic amine receptor	0.0121	0.2496	0.2485
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0121	0.2496	0.2485
Brugia malayi	hypothetical protein	0.0121	0.2496	0.8687
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Brugia malayi	G protein-coupled receptor	0.0121	0.2496	0.8687
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0121	0.2496	0.2485
Brugia malayi	sulfakinin receptor protein	0.0121	0.2496	0.8687
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0121	0.2496	0.2485
Echinococcus granulosus	neuropeptide receptor	0.0121	0.2496	0.2485
Echinococcus granulosus	fmrfamide receptor	0.0121	0.2496	0.2485
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0121	0.2496	0.2485
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0121	0.2496	0.2485
Schistosoma mansoni	DNA topoisomerase type I	0.0103	0.2105	0.2092
Onchocerca volvulus		0.0121	0.2496	1
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0121	0.2496	0.2485
Onchocerca volvulus		0.0121	0.2496	1
Brugia malayi	putative neuropeptide receptor	0.0121	0.2496	0.8687
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0007	0	0.5
Brugia malayi	AKH receptor	0.0121	0.2496	0.8687
Onchocerca volvulus		0.0121	0.2496	1
Echinococcus multilocularis	somatostatin receptor	0.0121	0.2496	0.2485
Echinococcus granulosus	neuropeptide Y receptor	0.0121	0.2496	0.2485
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Schistosoma mansoni	opsin-like receptor	0.0121	0.2496	0.2485
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0121	0.2496	0.2485
Echinococcus granulosus	g protein coupled receptor	0.0121	0.2496	0.2485
Onchocerca volvulus		0.0121	0.2496	1
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0121	0.2496	0.2485
Echinococcus granulosus	neuropeptides capa receptor	0.0121	0.2496	0.2485
Echinococcus granulosus	serotonin receptor	0.0121	0.2496	0.2485
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0121	0.2496	0.2485
Schistosoma mansoni	DNA topoisomerase type I	0.0103	0.2105	0.2092
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0121	0.2496	0.2485
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0121	0.2496	0.2485
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0121	0.2496	0.2485
Schistosoma mansoni	hypothetical protein	0.0013	0.0119	0.0104
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0	0.5
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0121	0.2496	0.8687
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0121	0.2496	0.2485
Brugia malayi	hypothetical protein	0.0121	0.2496	0.8687
Schistosoma mansoni	hypothetical protein	0.0121	0.2496	0.2485
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0	0.5
Brugia malayi	hypothetical protein	0.0121	0.2496	0.8687
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0121	0.2496	0.2485
Schistosoma mansoni	adenoreceptor	0.0121	0.2496	0.2485
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0121	0.2496	0.8687
Schistosoma mansoni	biogenic amine receptor	0.0121	0.2496	0.2485
Onchocerca volvulus		0.0121	0.2496	1
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Onchocerca volvulus		0.0121	0.2496	1
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Trichomonas vaginalis	helicase, putative	0.0007	0	0.5
Loa Loa (eye worm)	TYRA-2 protein	0.0121	0.2496	0.8686
Echinococcus multilocularis	serotonin receptor	0.0121	0.2496	0.2485
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0121	0.2496	0.2485
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0	0.5
Schistosoma mansoni	neuropeptide F-like receptor	0.0121	0.2496	0.2485
Echinococcus multilocularis	neuropeptide receptor	0.0121	0.2496	0.2485
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Brugia malayi	hypothetical protein	0.0121	0.2496	0.8687
Echinococcus multilocularis	cpg binding protein	0.0034	0.0593	0.0578
Echinococcus multilocularis	neuropeptide Y receptor	0.0121	0.2496	0.2485
Schistosoma mansoni	amine GPCR	0.0121	0.2496	0.2485
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0	0.5
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0121	0.2496	0.2485
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Onchocerca volvulus		0.0121	0.2496	1
Echinococcus multilocularis	fmrfamide receptor	0.0121	0.2496	0.2485
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0121	0.2496	0.2485
Echinococcus granulosus	g protein coupled receptor	0.0121	0.2496	0.2485
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0121	0.2496	0.2485
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0121	0.2496	0.2485
Loa Loa (eye worm)	hypothetical protein	0.0121	0.2496	0.8686
Brugia malayi	follicle stimulating hormone receptor	0.0121	0.2496	0.8687
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0121	0.2496	0.2485

Activities

Activity type	Activity value	Assay description	Source	Reference
Zone size (functional)	= 9 mM	Antifungal activity against Aspergillus fumigatus at a concentration of 1 mg/mL in MeOH; Zone: hazy diffused	ChEMBL.	14980649
Zone size (functional)	= 22 mM	Antifungal activity against Candida albicans at a concentration of 1 mg/mL in MeOH	ChEMBL.	14980649
Zone size (functional)	= 22 mM	Antifungal activity against Candida albicans at a concentration of 2 mg/mL in MeOH	ChEMBL.	14980649
Zone size (functional)	= 22 mM	Antifungal activity against Candida albicans at a concentration of 1 mg/mL in MeOH	ChEMBL.	14980649
Zone size (functional)	= 22 mM	Antifungal activity against Candida albicans at a concentration of 2 mg/mL in MeOH	ChEMBL.	14980649
Zone size (functional)	= 23 mM	Antifungal activity against Aspergillus fumigatus at a concentration of 2 mg/mL in MeOH; Zone: hazy diffused	ChEMBL.	14980649
Zone size (functional)	= 25 mM	Antifungal activity against Candida albicans at a concentration of 5 mg/mL in MeOH	ChEMBL.	14980649
Zone size (functional)	= 25 mM	Antifungal activity against Aspergillus fumigatus at a concentration of 5 mg/mL in MeOH; Zone: hazy diffused	ChEMBL.	14980649
Zone size (functional)	= 25 mM	Antifungal activity against Candida albicans at a concentration of 5 mg/mL in MeOH	ChEMBL.	14980649
Zone size (functional)	= 30 mM	Antifungal activity against Aspergillus fumigatus at a concentration of 1 mg/mL in MeOH; Zone: hazy diffused	ChEMBL.	14980649

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: CHEMBL438649

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 375751