TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 406.395 | Formula: C20H18N6O4
H donors: 2 H acceptors: 4 LogP: 1.7 Rotable bonds: 2
Rule of 5 violations (Lipinski): 1
SMILES: O=C1CC(C)(C)CC2=C1C(c1ccc(cc1)[N+](=O)[O-])c1c(N2)nc2n(c1=O)cn[nH]2
InChi: 1S/C20H18N6O4/c1-20(2)7-12-15(13(27)8-20)14(10-3-5-11(6-4-10)26(29)30)16-17(22-12)23-19-24-21-9-25(19)18(16)28/h3-6,9,14,22H,7-8H2,1-2H3,(H,23,24)
InChiKey: IRRSXRBTGWXCBB-UHFFFAOYSA-N

Network

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Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

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Clustering layers

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Synonyms

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
Onchocerca volvulus		0.004	0.0645	1
Echinococcus granulosus	neuropeptides capa receptor	0.004	0.0645	0.1185
Brugia malayi	jmjC domain containing protein	0.0097	0.2341	0.43
Brugia malayi	G protein-coupled receptor	0.004	0.0645	0.1185
Echinococcus multilocularis	neuropeptide Y receptor	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0395	0.7019
Echinococcus granulosus	serotonin receptor	0.004	0.0645	0.1185
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0089	0.2107	0.3871
Echinococcus granulosus	dro:myosuppressin receptor	0.004	0.0645	0.1185
Echinococcus granulosus	rhodopsin orphan GPCR	0.004	0.0645	0.1185
Schistosoma mansoni	neuropeptide receptor	0.004	0.0645	0.1185
Schistosoma mansoni	hypothetical protein	0.003	0.0326	0.0599
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0455	0.0836
Echinococcus multilocularis	orexin receptor type 2	0.004	0.0645	0.1185
Echinococcus multilocularis	acetylcholinesterase	0.02	0.5443	1
Schistosoma mansoni	biogenic amine receptor	0.004	0.0645	0.1185
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.004	0.0645	0.1185
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.004	0.0645	0.1185
Echinococcus multilocularis	neuroligin	0.0034	0.0455	0.0836
Schistosoma mansoni	amine GPCR	0.004	0.0645	0.1185
Echinococcus granulosus	biogenic amine 5HT receptor	0.004	0.0645	0.1185
Onchocerca volvulus		0.004	0.0645	1
Schistosoma mansoni	inositol monophosphatase	0.0037	0.0562	0.1033
Loa Loa (eye worm)	sugar transporter	0.0103	0.2517	0.4625
Trypanosoma cruzi	hexose transporter, putative	0.0032	0.0395	0.7019
Brugia malayi	Melatonin receptor type 1A	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.02	0.5443	1
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.004	0.0645	0.1185
Schistosoma mansoni	hypothetical protein	0.0164	0.4353	0.7996
Schistosoma mansoni	glucose transport protein	0.0103	0.2517	0.4625
Schistosoma mansoni	amine GPCR	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Onchocerca volvulus		0.004	0.0645	1
Schistosoma mansoni	gliotactin	0.0034	0.0455	0.0836
Leishmania major	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0037	0.0562	1
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.004	0.0645	0.1185
Brugia malayi	sulfakinin receptor protein	0.004	0.0645	0.1185
Schistosoma mansoni	hypothetical protein	0.004	0.0645	0.1185
Onchocerca volvulus		0.0034	0.0455	0.4038
Loa Loa (eye worm)	jmjC domain-containing protein	0.0061	0.1269	0.2331
Loa Loa (eye worm)	neuropeptide F receptor	0.004	0.0645	0.1185
Echinococcus granulosus	sex peptide receptor	0.004	0.0645	0.1185
Mycobacterium ulcerans	carboxylesterase, LipT	0.0034	0.0455	0.8087
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.004	0.0645	0.1185
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.004	0.0645	0.1185
Echinococcus granulosus	rhodopsin orphan GPCR	0.004	0.0645	0.1185
Trichomonas vaginalis	glucose transporter, putative	0.0032	0.0395	0.1568
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0089	0.2107	0.3871
Trypanosoma cruzi	hexose transporter	0.0032	0.0395	0.7019
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.004	0.0645	0.1185
Echinococcus granulosus	neuropeptide receptor	0.004	0.0645	0.1185
Echinococcus granulosus	orexin receptor type 2	0.004	0.0645	0.1185
Schistosoma mansoni	biogenic amine (5HT) receptor	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.005	0.0955	0.1754
Trichomonas vaginalis	sugar transporter, putative	0.0032	0.0395	0.1568
Brugia malayi	neuropeptide F receptor	0.004	0.0645	0.1185
Echinococcus multilocularis	rhodopsin orphan GPCR	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Trichomonas vaginalis	spcc417.12 protein, putative	0.0034	0.0455	0.1807
Plasmodium falciparum	hexose transporter	0.0103	0.2517	1
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Echinococcus multilocularis	peregrin	0.003	0.0326	0.0599
Schistosoma mansoni	glucose transport protein	0.0103	0.2517	0.4625
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0034	0.0455	1
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Echinococcus granulosus	carboxylesterase 5A	0.02	0.5443	1
Toxoplasma gondii	inositol(myo)-1(or 4)-monophosphatase 2, putative	0.0037	0.0562	0.1079
Schistosoma mansoni	BC026374 protein (S09 family)	0.0034	0.0455	0.0836
Loa Loa (eye worm)	neuropeptide F receptor	0.004	0.0645	0.1185
Echinococcus multilocularis	G-protein coupled receptor, putative	0.004	0.0645	0.1185
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.02	0.5443	1
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0034	0.0455	1
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0089	0.2107	0.3871
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.004	0.0645	0.1185
Brugia malayi	Carboxylesterase family protein	0.0034	0.0455	0.0836
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.004	0.0645	0.1185
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.004	0.0645	0.1185
Schistosoma mansoni	hypothetical protein	0.004	0.0645	0.1185
Brugia malayi	GnHR receptor homolog	0.004	0.0645	0.1185
Echinococcus granulosus	neuropeptide receptor	0.004	0.0645	0.1185
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0395	0.7019
Echinococcus granulosus	neuropeptide FF receptor 2	0.004	0.0645	0.1185
Schistosoma mansoni	neuropeptide F-like receptor	0.004	0.0645	0.1185
Brugia malayi	G-protein coupled receptor	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Echinococcus granulosus	neuropeptides capa receptor	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Trichomonas vaginalis	sugar transporter, putative	0.0032	0.0395	0.1568
Loa Loa (eye worm)	G-protein coupled receptor	0.004	0.0645	0.1185
Brugia malayi	Carboxylesterase family protein	0.0034	0.0455	0.0836
Mycobacterium tuberculosis	Carboxylesterase LipT	0.0034	0.0455	1
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.004	0.0645	0.1185
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Echinococcus granulosus	tm gpcr rhodopsin	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.004	0.0645	0.1185
Echinococcus multilocularis	g-protein coupled receptor	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0103	0.2517	0.4625
Schistosoma mansoni	neuropeptide receptor	0.004	0.0645	0.1185
Echinococcus multilocularis	serotonin receptor	0.004	0.0645	0.1185
Brugia malayi	hypothetical protein	0.004	0.0645	0.1185
Schistosoma mansoni	hypothetical protein	0.004	0.0645	0.1185
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.004	0.0645	0.1185
Echinococcus multilocularis	neuropeptide receptor	0.004	0.0645	0.1185
Brugia malayi	hypothetical protein	0.004	0.0645	0.1185
Brugia malayi	hypothetical protein	0.0034	0.0455	0.0836
Schistosoma mansoni	bromodomain-containing nuclear protein 1 brd1	0.003	0.0326	0.0599
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0037	0.0562	1
Toxoplasma gondii	facilitative glucose transporter GT1	0.0103	0.2517	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.004	0.0645	0.1185
Echinococcus granulosus	peptide allatostatin:somatostatin	0.004	0.0645	0.1185
Entamoeba histolytica	hypothetical protein	0.01	0.2445	0.2445
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.004	0.0645	0.1185
Echinococcus multilocularis	neuropeptide receptor	0.004	0.0645	0.1185
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.004	0.0645	0.1185
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0034	0.0455	0.0836
Brugia malayi	follicle stimulating hormone receptor	0.004	0.0645	0.1185
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.004	0.0645	0.1185
Loa Loa (eye worm)	inositol-1	0.0037	0.0562	0.1033
Schistosoma mansoni	amine GPCR	0.004	0.0645	0.1185
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.004	0.0645	0.1185
Echinococcus granulosus	lysine specific demethylase 5A	0.0036	0.0512	0.0941
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0959	0.1761
Schistosoma mansoni	amine GPCR	0.004	0.0645	0.1185
Echinococcus multilocularis	fmrfamide receptor	0.004	0.0645	0.1185
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.004	0.0645	0.1185
Brugia malayi	hypothetical protein	0.004	0.0645	0.1185
Giardia lamblia	DNA repair protein RAD52	0.0352	1	1
Echinococcus granulosus	g protein coupled receptor	0.004	0.0645	0.1185
Echinococcus granulosus	rhodopsin orphan GPCR	0.004	0.0645	0.1185
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0037	0.0562	0.2234
Brugia malayi	Sugar transporter family protein	0.0103	0.2517	0.4625
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.004	0.0645	0.1185
Echinococcus multilocularis	rhodopsin orphan GPCR	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Schistosoma mansoni	growth hormone secretagogue receptor	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Echinococcus multilocularis	jumonji domain containing protein	0.0041	0.0673	0.1236
Trichomonas vaginalis	conserved hypothetical protein	0.0032	0.0395	0.1568
Echinococcus multilocularis	PHD finger protein rhinoceros	0.003	0.0326	0.0599
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.004	0.0645	0.1185
Echinococcus multilocularis	neuropeptides capa receptor	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Brugia malayi	RE15519p	0.004	0.0645	0.1185
Echinococcus granulosus	neuropeptide Y receptor	0.004	0.0645	0.1185
Schistosoma mansoni	amine GPCR	0.004	0.0645	0.1185
Echinococcus multilocularis	fmrfamide receptor	0.004	0.0645	0.1185
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.004	0.0645	0.1185
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0089	0.2107	0.3871
Echinococcus granulosus	tachykinin peptides receptor 99D	0.004	0.0645	0.1185
Trypanosoma cruzi	hexose transporter, putative	0.0032	0.0395	0.7019
Trichomonas vaginalis	conserved hypothetical protein	0.0103	0.2517	1
Schistosoma mansoni	inositol monophosphatase	0.0037	0.0562	0.1033
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.005	0.0955	0.1754
Schistosoma mansoni	neuropeptide receptor	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0455	0.0836
Brugia malayi	hypothetical protein	0.004	0.0645	0.1185
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0037	0.0562	0.2234
Brugia malayi	Bromodomain containing protein	0.003	0.0326	0.0599
Echinococcus granulosus	neuropeptide s receptor	0.004	0.0645	0.1185
Mycobacterium ulcerans	extragenic suppressor protein SuhB	0.0037	0.0562	1
Schistosoma mansoni	neuropeptide f receptor 76f	0.004	0.0645	0.1185
Brugia malayi	hypothetical protein	0.004	0.0645	0.1185
Echinococcus granulosus	BC026374 protein S09 family	0.0034	0.0455	0.0836
Schistosoma mansoni	glucose transport protein	0.0103	0.2517	0.4625
Loa Loa (eye worm)	melatonin receptor type 1A	0.004	0.0645	0.1185
Echinococcus granulosus	rhodopsin orphan GPCR	0.004	0.0645	0.1185
Onchocerca volvulus		0.0034	0.0455	0.4038
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0089	0.2107	0.3871
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Echinococcus granulosus	7TM GPCR rhodopsin	0.004	0.0645	0.1185
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.004	0.0645	0.1185
Trichomonas vaginalis	carboxylesterase domain containing protein, putative	0.0034	0.0455	0.1807
Trichomonas vaginalis	sugar transporter, putative	0.0032	0.0395	0.1568
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Onchocerca volvulus		0.004	0.0645	1
Echinococcus granulosus	geminin	0.0164	0.4353	0.7996
Onchocerca volvulus		0.004	0.0645	1
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.004	0.0645	0.1185
Loa Loa (eye worm)	jmjC domain-containing protein	0.0036	0.0512	0.0941
Schistosoma mansoni	hypothetical protein	0.0034	0.0476	0.0874
Echinococcus granulosus	tm gpcr rhodopsin	0.004	0.0645	0.1185
Onchocerca volvulus		0.004	0.0645	1
Echinococcus granulosus	para nitrobenzyl esterase	0.0034	0.0455	0.0836
Echinococcus granulosus	fmrfamide receptor	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0032	0.0395	0.7019
Brugia malayi	putative neuropeptide receptor	0.004	0.0645	0.1185
Schistosoma mansoni	biogenic amine receptor	0.004	0.0645	0.1185
Mycobacterium tuberculosis	Inositol-1-monophosphatase SuhB	0.0033	0.0445	0.9781
Echinococcus granulosus	tm gpcr rhodopsin	0.004	0.0645	0.1185
Echinococcus granulosus	jumonji domain containing protein	0.0041	0.0673	0.1236
Echinococcus granulosus	g protein coupled receptor	0.004	0.0645	0.1185
Echinococcus multilocularis	solute carrier family 2, facilitated glucose	0.0103	0.2517	0.4625
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.004	0.0645	0.1185
Loa Loa (eye worm)	carboxylesterase	0.0034	0.0455	0.0836
Onchocerca volvulus		0.0034	0.0455	0.4038
Echinococcus multilocularis	General substrate transporter	0.0088	0.2085	0.383
Echinococcus granulosus	acetylcholinesterase	0.02	0.5443	1
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0476	0.0874
Onchocerca volvulus		0.004	0.0645	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.004	0.0645	0.1185
Brugia malayi	Dopamine receptor protein 2	0.004	0.0645	0.1185
Echinococcus granulosus	neuroligin	0.0034	0.0455	0.0836
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.004	0.0645	0.1185
Brugia malayi	Carboxylesterase family protein	0.0034	0.0455	0.0836
Brugia malayi	G protein-coupled receptor F59B2.13	0.004	0.0645	0.1185
Schistosoma mansoni	neuropeptide receptor	0.004	0.0645	0.1185
Brugia malayi	Serotonin receptor	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0455	0.0836
Loa Loa (eye worm)	PHD-finger family protein	0.003	0.0326	0.0599
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0089	0.2107	0.3871
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Schistosoma mansoni	opsin-like receptor	0.004	0.0645	0.1185
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.004	0.0645	0.1185
Schistosoma mansoni	opsin-like receptor	0.004	0.0645	0.1185
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Echinococcus multilocularis	somatostatin receptor	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0455	0.0836
Echinococcus granulosus	neuropeptide Y receptor	0.004	0.0645	0.1185
Brugia malayi	Inositol-1	0.0037	0.0562	0.1033
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Echinococcus multilocularis	lysine specific demethylase 5A	0.0036	0.0512	0.0941
Schistosoma mansoni	opsin-like receptor	0.004	0.0645	0.1185
Trypanosoma brucei	glucose transporter 1E	0.0032	0.0395	0.7019
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.004	0.0645	0.1185
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0103	0.2517	0.4625
Brugia malayi	putative neuropeptide receptor NPR1	0.004	0.0645	0.1185
Brugia malayi	hypothetical protein	0.004	0.0645	0.1185
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0103	0.2517	0.4625
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Echinococcus granulosus	G protein coupled receptor 139	0.004	0.0645	0.1185
Loa Loa (eye worm)	TYRA-2 protein	0.004	0.0645	0.1185
Echinococcus multilocularis	sex peptide receptor	0.004	0.0645	0.1185
Echinococcus multilocularis	Transcription factor, JmjC domain containing protein	0.0097	0.2341	0.43
Echinococcus granulosus	General substrate transporter	0.0088	0.2085	0.383
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0395	0.7019
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Onchocerca volvulus		0.004	0.0645	1
Echinococcus multilocularis	family S9 non peptidase ue (S09 family)	0.0034	0.0455	0.0836
Schistosoma mansoni	hypothetical protein	0.004	0.0645	0.1185
Echinococcus multilocularis	g protein coupled receptor	0.004	0.0645	0.1185
Echinococcus multilocularis	allatostatin A receptor	0.004	0.0645	0.1185
Plasmodium vivax	hexose transporter	0.0103	0.2517	1
Echinococcus granulosus	somatostatin receptor	0.004	0.0645	0.1185
Echinococcus multilocularis	rhodopsin orphan GPCR	0.004	0.0645	0.1185
Onchocerca volvulus		0.004	0.0645	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0089	0.2107	0.3871
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0034	0.0455	0.0836
Brugia malayi	ORL1-like opioid receptor	0.004	0.0645	0.1185
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.004	0.0645	0.1185
Onchocerca volvulus		0.004	0.0645	1
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Echinococcus multilocularis	neuropeptide Y receptor	0.004	0.0645	0.1185
Echinococcus multilocularis	g protein coupled receptor	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Brugia malayi	Carboxylesterase family protein	0.02	0.5443	1
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0103	0.2517	0.4625
Leishmania major	glucose transporter, lmgt2	0.0032	0.0395	0.7019
Entamoeba histolytica	myo-inositol monophosphatase, putative	0.0037	0.0562	0.0562
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0455	0.0836
Onchocerca volvulus		0.004	0.0645	1
Brugia malayi	hypothetical protein	0.004	0.0645	0.1185
Entamoeba histolytica	Rad52/22 family double-strand break repair protein, putative	0.01	0.2445	0.2445
Brugia malayi	hypothetical protein	0.004	0.0645	0.1185
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0032	0.0395	0.7019
Echinococcus granulosus	peregrin	0.003	0.0326	0.0599
Onchocerca volvulus		0.004	0.0645	1
Schistosoma mansoni	histamine h1 receptor	0.004	0.0645	0.1185
Loa Loa (eye worm)	carboxylesterase	0.02	0.5443	1
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0034	0.0455	0.0836
Echinococcus multilocularis	rhodopsin orphan GPCR	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Echinococcus multilocularis	rhodopsin orphan GPCR	0.004	0.0645	0.1185
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.004	0.0645	0.1185
Brugia malayi	Tachykinin-like peptides receptor 99D	0.004	0.0645	0.1185
Trichomonas vaginalis	glucose transporter, putative	0.0032	0.0395	0.1568
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.004	0.0645	0.1185
Trichomonas vaginalis	conserved hypothetical protein	0.0032	0.0395	0.1568
Schistosoma mansoni	acetylcholinesterase	0.0034	0.0455	0.0836
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0036	0.0512	0.0941
Schistosoma mansoni	neuropeptide F-like receptor	0.004	0.0645	0.1185
Echinococcus granulosus	7tm_1 domain containing protein	0.004	0.0645	0.1185
Echinococcus multilocularis	para nitrobenzyl esterase	0.0034	0.0455	0.0836
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.004	0.0645	0.1185
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.004	0.0645	0.1185
Echinococcus multilocularis	rhodopsin orphan GPCR	0.004	0.0645	0.1185
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0032	0.0395	0.7019
Onchocerca volvulus		0.004	0.0645	1
Onchocerca volvulus		0.0034	0.0455	0.4038
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0103	0.2517	0.4625
Schistosoma mansoni	jumonji domain containing protein	0.0077	0.1745	0.3205
Echinococcus granulosus	inositol monophosphatase 1	0.0037	0.0562	0.1033
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Echinococcus granulosus	alpha 1A adrenergic receptor	0.004	0.0645	0.1185
Echinococcus granulosus	Transcription factor JmjC domain containing protein	0.0097	0.2341	0.43
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0089	0.2107	0.3871
Echinococcus multilocularis	inositol monophosphatase 1	0.0037	0.0562	0.1033
Trypanosoma brucei	glucose transporter 2A	0.0032	0.0395	0.7019
Echinococcus granulosus	allatostatin A receptor	0.004	0.0645	0.1185
Echinococcus granulosus	rhodopsin orphan GPCR	0.004	0.0645	0.1185
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.005	0.0955	0.1754
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.004	0.0645	0.1185
Giardia lamblia	PHD finger protein 15	0.003	0.0326	0.0326
Brugia malayi	jmjC domain containing protein	0.0036	0.0512	0.0941
Echinococcus multilocularis	rhodopsin orphan GPCR	0.004	0.0645	0.1185
Schistosoma mansoni	myosin xvIII	0.004	0.0645	0.1185
Trichomonas vaginalis	inositol monophosphatase, putative	0.0037	0.0562	0.2234
Echinococcus multilocularis	carboxylesterase 5A	0.02	0.5443	1
Echinococcus multilocularis	geminin	0.0164	0.4353	0.7996
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0395	0.7019
Onchocerca volvulus	Dopamine\/Ecdysteroid receptor homolog	0.004	0.0645	1
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0036	0.0512	0.0941
Echinococcus multilocularis	dro:myosuppressin receptor	0.004	0.0645	0.1185
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0395	0.7019
Echinococcus multilocularis	serotonin receptor	0.004	0.0645	0.1185
Onchocerca volvulus		0.004	0.0645	1
Echinococcus granulosus	hypothetical protein	0.004	0.0645	0.1185
Onchocerca volvulus		0.004	0.0645	1
Loa Loa (eye worm)	acetylcholinesterase 1	0.02	0.5443	1
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Schistosoma mansoni	neuroligin 3 (S09 family)	0.0034	0.0455	0.0836
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.004	0.0645	0.1185
Echinococcus multilocularis	neuropeptide FF receptor 2	0.004	0.0645	0.1185
Schistosoma mansoni	adenoreceptor	0.004	0.0645	0.1185
Brugia malayi	AKH receptor	0.004	0.0645	0.1185
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.004	0.0645	0.1185
Echinococcus multilocularis	neuropeptide s receptor	0.004	0.0645	0.1185
Brugia malayi	latrophilin 2 splice variant baaae	0.0034	0.0476	0.0874
Onchocerca volvulus		0.004	0.0645	1
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.004	0.0645	0.1185
Echinococcus multilocularis	acetylcholinesterase	0.02	0.5443	1
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Brugia malayi	G-protein coupled receptor	0.004	0.0645	0.1185
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0103	0.2517	0.4625
Echinococcus granulosus	acetylcholinesterase	0.02	0.5443	1
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.003	0.0326	0.0599
Echinococcus granulosus	family S9 non peptidase ue S09 family	0.0034	0.0455	0.0836
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0103	0.2517	0.4625
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0455	0.0836
Echinococcus multilocularis	neuropeptides capa receptor	0.004	0.0645	0.1185
Brugia malayi	hypothetical protein	0.004	0.0645	0.1185
Brugia malayi	Dopamine receptor protein 1	0.004	0.0645	0.1185
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0455	0.0836
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.004	0.0645	0.1185
Brugia malayi	Carboxylesterase family protein	0.02	0.5443	1
Brugia malayi	neuropeptide F receptor	0.004	0.0645	0.1185
Echinococcus granulosus	PHD finger protein rhinoceros	0.003	0.0326	0.0599
Schistosoma mansoni	biogenic amine (5HT) receptor	0.004	0.0645	0.1185
Brugia malayi	Serotonin receptor	0.004	0.0645	0.1185
Leishmania major	glucose transporter, lmgt3	0.0032	0.0395	0.7019
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Echinococcus multilocularis	neuropeptide receptor A26	0.004	0.0645	0.1185
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.004	0.0645	0.1185
Schistosoma mansoni	hypothetical protein	0.0164	0.4353	0.7996
Loa Loa (eye worm)	carboxylesterase	0.0034	0.0455	0.0836
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Echinococcus multilocularis	g protein coupled receptor	0.004	0.0645	0.1185
Onchocerca volvulus	Neuropeptide F receptor homolog	0.004	0.0645	1
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Echinococcus granulosus	neuropeptide receptor A26	0.004	0.0645	0.1185
Leishmania major	glucose transporter/membrane transporter D2, putative	0.0032	0.0395	0.7019
Onchocerca volvulus		0.0034	0.0455	0.4038
Onchocerca volvulus		0.004	0.0645	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.004	0.0645	0.1185
Brugia malayi	Calcitonin receptor-like protein seb-1	0.005	0.0955	0.1754
Echinococcus granulosus	g-protein coupled receptor	0.004	0.0645	0.1185
Echinococcus granulosus	biogenic amine 5HT receptor	0.004	0.0645	0.1185
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.004	0.0645	0.1185
Trypanosoma cruzi	hexose transporter, putative	0.0032	0.0395	0.7019
Wolbachia endosymbiont of Brugia malayi	fructose-1,6-bisphosphatase	0.0037	0.0562	0.5
Mycobacterium leprae	possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ).	0.0033	0.0445	0.5
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.004	0.0645	0.1185
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0395	0.7019
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0395	0.7019
Echinococcus multilocularis	G protein coupled receptor 139	0.004	0.0645	0.1185
Schistosoma mansoni	hypothetical protein	0.0103	0.2517	0.4625
Echinococcus granulosus	g protein coupled receptor	0.004	0.0645	0.1185
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.004	0.0645	0.1185
Echinococcus multilocularis	BC026374 protein (S09 family)	0.0034	0.0455	0.0836
Loa Loa (eye worm)	G-protein coupled receptor	0.004	0.0645	0.1185
Schistosoma mansoni	alpha-1 adrenergic receptor	0.004	0.0645	0.1185
Brugia malayi	PHD-finger family protein	0.003	0.0326	0.0599
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.004	0.0645	0.1185
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Brugia malayi	larval opioid receptor	0.004	0.0645	0.1185
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0395	0.7019
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.004	0.0645	0.1185
Brugia malayi	Carboxylesterase family protein	0.0034	0.0455	0.0836
Leishmania major	glucose transporter, lmgt1	0.0032	0.0395	0.7019
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0037	0.0562	1
Brugia malayi	Dopamine receptor	0.004	0.0645	0.1185
Trypanosoma brucei	inositol-1(or 4)-monophosphatase 1, putative	0.0037	0.0562	1
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Brugia malayi	hypothetical protein	0.004	0.0645	0.1185
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.004	0.0645	0.1185
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0089	0.2107	0.3871
Schistosoma mansoni	biogenic amine receptor	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.02	0.5443	1
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Loa Loa (eye worm)	hypothetical protein	0.004	0.0645	0.1185
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.004	0.0645	0.1185

Activities

Activity type	Activity value	Assay description	Source	Reference
Activity (functional)	= 51 %	Antitumor activity against human HeLa cells xenografted in Swiss albino mouse assessed as increase mouse life span at 10 ug/kg, ip for 10 days relative to control	ChEMBL.	21074295
Activity (functional)	= 55 %	Antitumor activity against human HepG2 cells xenografted in Swiss albino mouse assessed as increase mouse life span at 10 ug/kg, ip for 10 days relative to control	ChEMBL.	21074295
IZ (functional)	= 9 mm	Antifungal activity against Candida albicans at 50 mg/disk after 5 days by agar disk diffusion method	ChEMBL.	21074295
IZ (functional)	= 19 mm	Antibacterial activity against Escherichia coli at 50 mg/disk after 24 to 28 hrs by agar disk diffusion method	ChEMBL.	21074295
LD50 (ADMET)	= 98 ug/kg	Acute toxicity in human HeLa cells xenografted ip dosed Swiss albino mouse assessed as mortality measured up to 2 weeks	ChEMBL.	21074295
LD50 (ADMET)	= 100 ug/kg	Acute toxicity in human HepG2 cells xenografted ip dosed Swiss albino mouse assessed as mortality measured up to 2 weeks	ChEMBL.	21074295
MIC (functional)	= 40 mg/ml	Antibacterial activity against Escherichia coli after 24 to 28 hrs by agar disk diffusion method	ChEMBL.	21074295
MIC (functional)	= 40 mg/ml	Antifungal activity against Candida albicans after 5 days by agar disk diffusion method	ChEMBL.	21074295
Survival (functional)	= 30 day	Antitumor activity against human HeLa cells xenografted in Swiss albino mouse assessed as increase of mouse survival at 10 ug/kg, ip for 10 days (Rvb = 22 +/- 1.90 day)	ChEMBL.	21074295
Survival (functional)	= 31 day	Antitumor activity against human HepG2 cells xenografted in Swiss albino mouse assessed as increase of mouse survival at 10 ug/kg, ip for 10 days (Rvb = 22 +/- 1.90 day)	ChEMBL.	21074295

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: CHEMBL1651255

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1490275