TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 1030.19 | Formula: C48H71N17O9
H donors: 15 H acceptors: 9 LogP: -2.56 Rotable bonds: 22
Rule of 5 violations (Lipinski): 3
SMILES: NCC[C@@H]1NC(=O)[C@H](CCCCNC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC1=O)Cc1ccccc1)CCCNC(=N)N)Cc1c[nH]c2c1cccc2)C(=O)N)NC(=O)[C@@H](NC(=O)C)CCCNC(=N)N
InChi: 1S/C48H71N17O9/c1-27(66)59-32(16-9-21-56-47(51)52)41(69)60-33-15-7-8-20-55-39(67)25-36(40(50)68)63-46(74)38(24-29-26-58-31-14-6-5-13-30(29)31)65-43(71)34(17-10-22-57-48(53)54)61-45(73)37(23-28-11-3-2-4-12-28)64-44(72)35(18-19-49)62-42(33)70/h2-6,11-14,26,32-38,58H,7-10,15-25,49H2,1H3,(H2,50,68)(H,55,67)(H,59,66)(H,60,69)(H,61,73)(H,62,70)(H,63,74)(H,64,72)(H,65,71)(H4,51,52,56)(H4,53,54,57)/t32-,33-,34-,35-,36-,37+,38-/m0/s1
InChiKey: SGDPPXLNWCBTAI-IQSCWYJSSA-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

Species	Target name	Source	Bibliographic reference
Homo sapiens	melanocortin 4 receptor	Starlite/ChEMBL	No references

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
Brugia malayi	G protein-coupled receptor F59B2.13	0.0091	0.0242	0.0427
Echinococcus granulosus	allatostatin A receptor	0.0091	0.0242	0.0242
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0091	0.0242	0.0595
Echinococcus granulosus	hypothetical protein	0.0091	0.0242	0.0242
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Schistosoma mansoni	sodium/chloride dependent neurotransmitter transporter	0.0072	0.0019	0.0046
Echinococcus granulosus	neuropeptide Y receptor	0.0091	0.0242	0.0242
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0091	0.0242	0.0242
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.007	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Loa Loa (eye worm)	hypothetical protein	0.0423	0.4065	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0091	0.0242	0.0242
Schistosoma mansoni	neuropeptide F-like receptor	0.0091	0.0242	0.0595
Echinococcus multilocularis	allatostatin A receptor	0.0091	0.0242	0.0242
Brugia malayi	Sodium:neurotransmitter symporter family protein	0.0072	0.0019	0.0033
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0091	0.0242	0.0242
Loa Loa (eye worm)	hypothetical protein	0.0072	0.0019	0.0046
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Brugia malayi	hypothetical protein	0.0091	0.0242	0.0427
Echinococcus multilocularis	neuropeptides capa receptor	0.0091	0.0242	0.0242
Brugia malayi	hypothetical protein	0.0091	0.0242	0.0427
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0091	0.0242	0.0595
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Echinococcus multilocularis	neuropeptide Y receptor	0.0091	0.0242	0.0242
Loa Loa (eye worm)	serotonin transporter b	0.0423	0.4065	1
Schistosoma mansoni	opsin-like receptor	0.0091	0.0242	0.0595
Schistosoma mansoni	histamine h1 receptor	0.0091	0.0242	0.0595
Echinococcus granulosus	dro:myosuppressin receptor	0.0091	0.0242	0.0242
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0091	0.0242	0.0595
Brugia malayi	putative neuropeptide receptor NPR1	0.0091	0.0242	0.0427
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0091	0.0242	0.0595
Echinococcus multilocularis	sodium:chloride dependent neurotransmitter	0.0072	0.0019	0.0019
Plasmodium vivax	hypothetical protein, conserved	0.0072	0.0019	0.5
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Echinococcus granulosus	acetylcholinesterase	0.0415	0.3977	0.3977
Echinococcus multilocularis	g protein coupled receptor	0.0091	0.0242	0.0242
Echinococcus multilocularis	serotonin receptor	0.0091	0.0242	0.0242
Echinococcus granulosus	uncharacterized sodium dependent transporter	0.0072	0.0019	0.0019
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0091	0.0242	0.0242
Loa Loa (eye worm)	melatonin receptor type 1A	0.0091	0.0242	0.0595
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0091	0.0242	0.0427
Brugia malayi	Melatonin receptor type 1A	0.0091	0.0242	0.0427
Echinococcus multilocularis	neuropeptide Y receptor	0.0091	0.0242	0.0242
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0091	0.0242	0.0595
Schistosoma mansoni	hypothetical protein	0.0091	0.0242	0.0595
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0091	0.0242	0.0595
Trichomonas vaginalis	spcc417.12 protein, putative	0.007	0	0.5
Onchocerca volvulus		0.0091	0.0242	0.0595
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0091	0.0242	0.0242
Onchocerca volvulus		0.0091	0.0242	0.0595
Loa Loa (eye worm)	G-protein coupled receptor	0.0091	0.0242	0.0595
Brugia malayi	Dopamine receptor protein 1	0.0091	0.0242	0.0427
Brugia malayi	hypothetical protein	0.0091	0.0242	0.0427
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0091	0.0242	0.0242
Echinococcus granulosus	rhodopsin orphan GPCR	0.0091	0.0242	0.0242
Echinococcus granulosus	acetylcholinesterase	0.0415	0.3977	0.3977
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Loa Loa (eye worm)	TYRA-2 protein	0.0091	0.0242	0.0595
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0091	0.0242	0.0242
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0091	0.0242	0.0595
Onchocerca volvulus		0.0091	0.0242	0.0595
Echinococcus granulosus	carboxylesterase 5A	0.0415	0.3977	0.3977
Schistosoma mansoni	hypothetical protein	0.0091	0.0242	0.0595
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0091	0.0242	0.0242
Echinococcus granulosus	neuropeptide s receptor	0.0091	0.0242	0.0242
Onchocerca volvulus		0.0091	0.0242	0.0595
Schistosoma mansoni	hypothetical protein	0.0091	0.0242	0.0595
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Echinococcus multilocularis	acetylcholinesterase	0.0415	0.3977	0.3977
Echinococcus multilocularis	neuropeptides capa receptor	0.0091	0.0242	0.0242
Loa Loa (eye worm)	hypothetical protein	0.0415	0.3977	0.9784
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Brugia malayi	G-protein coupled receptor	0.0091	0.0242	0.0427
Schistosoma mansoni	neuropeptide receptor	0.0091	0.0242	0.0595
Brugia malayi	sulfakinin receptor protein	0.0091	0.0242	0.0427
Echinococcus granulosus	neuropeptide receptor	0.0091	0.0242	0.0242
Brugia malayi	G protein-coupled receptor	0.0091	0.0242	0.0427
Brugia malayi	Sodium:neurotransmitter symporter family protein	0.0072	0.0019	0.0033
Schistosoma mansoni	sodium/chloride dependent transporter	0.0423	0.4065	1
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0091	0.0242	0.0595
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0091	0.0242	0.0242
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Onchocerca volvulus		0.0091	0.0242	0.0595
Onchocerca volvulus		0.0091	0.0242	0.0595
Onchocerca volvulus		0.0091	0.0242	0.0595
Echinococcus granulosus	g-protein coupled receptor	0.0091	0.0242	0.0242
Mycobacterium tuberculosis	Carboxylesterase LipT	0.007	0	0.5
Schistosoma mansoni	amine GPCR	0.0091	0.0242	0.0595
Schistosoma mansoni	sodium-dependent neurotransmitter transporter	0.0072	0.0019	0.0046
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0091	0.0242	0.0242
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0091	0.0242	0.0242
Echinococcus granulosus	fmrfamide receptor	0.0091	0.0242	0.0242
Brugia malayi	RE15519p	0.0091	0.0242	0.0427
Plasmodium falciparum	transporter, putative	0.0072	0.0019	0.5
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0091	0.0242	0.0242
Echinococcus multilocularis	neuropeptide receptor	0.0091	0.0242	0.0242
Echinococcus granulosus	orexin receptor type 2	0.0091	0.0242	0.0242
Schistosoma mansoni	amine GPCR	0.0091	0.0242	0.0595
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0091	0.0242	0.0595
Echinococcus multilocularis	g protein coupled receptor	0.0091	0.0242	0.0242
Schistosoma mansoni	sodium-dependent amino acid transporter	0.0072	0.0019	0.0046
Schistosoma mansoni	neuropeptide receptor	0.0091	0.0242	0.0595
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0091	0.0242	0.0595
Schistosoma mansoni	sodium/chloride dependent transporter	0.0072	0.0019	0.0046
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Echinococcus granulosus	sodium dependent neurotransmitter transporter	0.0072	0.0019	0.0019
Brugia malayi	hypothetical protein	0.0091	0.0242	0.0427
Schistosoma mansoni	sodium/chloride dependent transporter	0.0072	0.0019	0.0046
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0091	0.0242	0.0427
Onchocerca volvulus		0.0091	0.0242	0.0595
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0091	0.0242	0.0595
Treponema pallidum	sodium- and chloride- dependent transporter	0.0423	0.4065	0.5
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0091	0.0242	0.0595
Onchocerca volvulus		0.0091	0.0242	0.0595
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0091	0.0242	0.0595
Schistosoma mansoni	sodium-dependent neurotransmitter transporter	0.0072	0.0019	0.0046
Echinococcus multilocularis	serotonin receptor	0.0091	0.0242	0.0242
Echinococcus granulosus	g protein coupled receptor	0.0091	0.0242	0.0242
Onchocerca volvulus	Neuropeptide F receptor homolog	0.0091	0.0242	0.0595
Loa Loa (eye worm)	hypothetical protein	0.0423	0.4065	1
Echinococcus multilocularis	serotonin transporter	0.0423	0.4065	0.4065
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0091	0.0242	0.0595
Onchocerca volvulus		0.0091	0.0242	0.0595
Echinococcus granulosus	serotonin transporter	0.0423	0.4065	0.4065
Brugia malayi	follicle stimulating hormone receptor	0.0091	0.0242	0.0427
Echinococcus multilocularis	orexin receptor type 2	0.0091	0.0242	0.0242
Echinococcus multilocularis	fmrfamide receptor	0.0091	0.0242	0.0242
Schistosoma mansoni	neuropeptide F-like receptor	0.0091	0.0242	0.0595
Echinococcus multilocularis	sex peptide receptor	0.0091	0.0242	0.0242
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0091	0.0242	0.0242
Brugia malayi	ORL1-like opioid receptor	0.0091	0.0242	0.0427
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Echinococcus multilocularis	somatostatin receptor	0.0091	0.0242	0.0242
Brugia malayi	G-protein coupled receptor	0.0091	0.0242	0.0427
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0091	0.0242	0.0427
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0415	0.3977	0.9784
Schistosoma mansoni	opsin-like receptor	0.0091	0.0242	0.0595
Schistosoma mansoni	opsin-like receptor	0.0091	0.0242	0.0595
Brugia malayi	Serotonin receptor	0.0561	0.5663	1
Onchocerca volvulus		0.0091	0.0242	0.0595
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0091	0.0242	0.0242
Brugia malayi	Carboxylesterase family protein	0.0415	0.3977	0.7022
Brugia malayi	putative neuropeptide receptor	0.0091	0.0242	0.0427
Schistosoma mansoni	norepinephrine/norepinephrine transporter	0.0423	0.4065	1
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0091	0.0242	0.0427
Brugia malayi	hypothetical protein	0.0091	0.0242	0.0427
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0091	0.0242	0.0427
Echinococcus multilocularis	G protein coupled receptor 139	0.0091	0.0242	0.0242
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Echinococcus granulosus	somatostatin receptor	0.0091	0.0242	0.0242
Echinococcus granulosus	neuropeptide FF receptor 2	0.0091	0.0242	0.0242
Schistosoma mansoni	sodium-dependent neurotransmitter transporter	0.0072	0.0019	0.0046
Brugia malayi	hypothetical protein	0.0091	0.0242	0.0427
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Onchocerca volvulus		0.0072	0.0019	0.0046
Echinococcus multilocularis	g-protein coupled receptor	0.0091	0.0242	0.0242
Schistosoma mansoni	amine GPCR	0.0091	0.0242	0.0595
Loa Loa (eye worm)	acetylcholinesterase 1	0.0415	0.3977	0.9784
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Schistosoma mansoni	growth hormone secretagogue receptor	0.0091	0.0242	0.0595
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0091	0.0242	0.0595
Echinococcus granulosus	sodium and chloride dependent glycine	0.0072	0.0019	0.0019
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0091	0.0242	0.0242
Schistosoma mansoni	neuropeptide receptor	0.0091	0.0242	0.0595
Loa Loa (eye worm)	norepinephrine transporter	0.0423	0.4065	1
Echinococcus granulosus	uncharacterized sodium dependent transporter	0.0072	0.0019	0.0019
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Brugia malayi	Sodium:neurotransmitter symporter family protein	0.0423	0.4065	0.7178
Schistosoma mansoni	neuropeptide receptor	0.0091	0.0242	0.0595
Brugia malayi	AKH receptor	0.0091	0.0242	0.0427
Loa Loa (eye worm)	hypothetical protein	0.0072	0.0019	0.0046
Echinococcus multilocularis	neuropeptide s receptor	0.0091	0.0242	0.0242
Echinococcus granulosus	neuropeptide Y receptor	0.0091	0.0242	0.0242
Onchocerca volvulus		0.0091	0.0242	0.0595
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0091	0.0242	0.0242
Schistosoma mansoni	myosin xvIII	0.0091	0.0242	0.0595
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0091	0.0242	0.0242
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0091	0.0242	0.0595
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0091	0.0242	0.0595
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0091	0.0242	0.0242
Echinococcus granulosus	g protein coupled receptor	0.0091	0.0242	0.0242
Loa Loa (eye worm)	hypothetical protein	0.0415	0.3977	0.9784
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0091	0.0242	0.0242
Echinococcus granulosus	neuropeptide receptor A26	0.0091	0.0242	0.0242
Echinococcus granulosus	tm gpcr rhodopsin	0.0091	0.0242	0.0242
Plasmodium falciparum	amino acid transporter, putative	0.0072	0.0019	0.5
Echinococcus multilocularis	neuropeptide receptor A26	0.0091	0.0242	0.0242
Echinococcus multilocularis	fmrfamide receptor	0.0091	0.0242	0.0242
Brugia malayi	GnHR receptor homolog	0.0091	0.0242	0.0427
Brugia malayi	hypothetical protein	0.0091	0.0242	0.0427
Loa Loa (eye worm)	hypothetical protein	0.0072	0.0019	0.0046
Onchocerca volvulus		0.0091	0.0242	0.0595
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Echinococcus granulosus	sodium:chloride dependent neurotransmitter	0.0072	0.0019	0.0019
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0091	0.0242	0.0242
Echinococcus multilocularis	dro:myosuppressin receptor	0.0091	0.0242	0.0242
Echinococcus granulosus	biogenic amine 5HT receptor	0.0091	0.0242	0.0242
Echinococcus granulosus	rhodopsin orphan GPCR	0.0091	0.0242	0.0242
Echinococcus granulosus	sodium and chloride dependent glycine	0.0072	0.0019	0.0019
Schistosoma mansoni	amine GPCR	0.0091	0.0242	0.0595
Echinococcus granulosus	7TM GPCR rhodopsin	0.0091	0.0242	0.0242
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0091	0.0242	0.0242
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0091	0.0242	0.0427
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0091	0.0242	0.0242
Loa Loa (eye worm)	hypothetical protein	0.0423	0.4065	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.0091	0.0242	0.0242
Onchocerca volvulus		0.0091	0.0242	0.0595
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0091	0.0242	0.0242
Loa Loa (eye worm)	solute carrier family 6 member 4	0.0423	0.4065	1
Echinococcus multilocularis	neuropeptide receptor	0.0091	0.0242	0.0242
Brugia malayi	hypothetical protein	0.0091	0.0242	0.0427
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.019	0.1383	0.3403
Plasmodium vivax	amine transporter, putative	0.0072	0.0019	0.5
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Brugia malayi	Carboxylesterase family protein	0.0415	0.3977	0.7022
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0091	0.0242	0.0595
Schistosoma mansoni	adenoreceptor	0.0091	0.0242	0.0595
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0091	0.0242	0.0595
Loa Loa (eye worm)	Sodium:neurotransmitter symporter family protein	0.0072	0.0019	0.0046
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Echinococcus granulosus	biogenic amine 5HT receptor	0.0091	0.0242	0.0242
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0091	0.0242	0.0595
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Echinococcus multilocularis	uncharacterized sodium dependent transporter	0.0072	0.0019	0.0019
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0091	0.0242	0.0242
Loa Loa (eye worm)	hypothetical protein	0.0072	0.0019	0.0046
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0091	0.0242	0.0595
Echinococcus multilocularis	sodium dependent neurotransmitter transporter	0.0072	0.0019	0.0019
Echinococcus granulosus	g protein coupled receptor	0.0091	0.0242	0.0242
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0091	0.0242	0.0242
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0091	0.0242	0.0242
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Loa Loa (eye worm)	G-protein coupled receptor	0.0091	0.0242	0.0595
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Echinococcus granulosus	neuropeptides capa receptor	0.0091	0.0242	0.0242
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Schistosoma mansoni	amine GPCR	0.0091	0.0242	0.0595
Onchocerca volvulus		0.0072	0.0019	0.0046
Loa Loa (eye worm)	neuropeptide F receptor	0.0091	0.0242	0.0595
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0091	0.0242	0.0595
Echinococcus multilocularis	acetylcholinesterase	0.0415	0.3977	0.3977
Schistosoma mansoni	hypothetical protein	0.0091	0.0242	0.0595
Loa Loa (eye worm)	hypothetical protein	0.0072	0.0019	0.0046
Schistosoma mansoni	biogenic amine receptor	0.0091	0.0242	0.0595
Brugia malayi	Sodium:neurotransmitter symporter family protein 1, putative	0.0072	0.0019	0.0033
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.0091	0.0242	0.0595
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0091	0.0242	0.0595
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Onchocerca volvulus		0.0072	0.0019	0.0046
Echinococcus granulosus	rhodopsin orphan GPCR	0.0091	0.0242	0.0242
Schistosoma mansoni	sodium/chloride dependent neurotransmitter transporter	0.0072	0.0019	0.0046
Brugia malayi	Dopamine receptor	0.0091	0.0242	0.0427
Onchocerca volvulus		0.0091	0.0242	0.0595
Onchocerca volvulus	Dopamine\/Ecdysteroid receptor homolog	0.0091	0.0242	0.0595
Onchocerca volvulus		0.0423	0.4065	1
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.0091	0.0242	0.0595
Echinococcus granulosus	serotonin receptor	0.0091	0.0242	0.0242
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0091	0.0242	0.0242
Loa Loa (eye worm)	hypothetical protein	0.0072	0.0019	0.0046
Echinococcus granulosus	tm gpcr rhodopsin	0.0091	0.0242	0.0242
Echinococcus multilocularis	carboxylesterase 5A	0.0415	0.3977	0.3977
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.007	0	0.5
Schistosoma mansoni	norepinephrine/norepinephrine transporter	0.0072	0.0019	0.0046
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0091	0.0242	0.0242
Brugia malayi	Serotonin receptor	0.0091	0.0242	0.0427
Brugia malayi	hypothetical protein	0.0091	0.0242	0.0427
Brugia malayi	Sodium:neurotransmitter symporter family protein	0.0072	0.0019	0.0033
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0091	0.0242	0.0242
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0091	0.0242	0.0595
Brugia malayi	Dopamine receptor protein 2	0.0091	0.0242	0.0427
Schistosoma mansoni	biogenic amine receptor	0.0091	0.0242	0.0595
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0091	0.0242	0.0595
Echinococcus granulosus	rhodopsin orphan GPCR	0.0091	0.0242	0.0242
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Echinococcus granulosus	neuropeptide receptor	0.0091	0.0242	0.0242
Brugia malayi	hypothetical protein	0.0072	0.0019	0.0033
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Loa Loa (eye worm)	Sodium:neurotransmitter symporter family protein	0.0072	0.0019	0.0046
Brugia malayi	neuropeptide F receptor	0.0091	0.0242	0.0427
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Mycobacterium ulcerans	carboxylesterase, LipT	0.007	0	0.5
Schistosoma mansoni	norepinephrine/norepinephrine transporter	0.0072	0.0019	0.0046
Echinococcus granulosus	neuropeptides capa receptor	0.0091	0.0242	0.0242
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0937	1	1
Loa Loa (eye worm)	hypothetical protein	0.0072	0.0019	0.0046
Echinococcus granulosus	rhodopsin orphan GPCR	0.0091	0.0242	0.0242
Onchocerca volvulus		0.0091	0.0242	0.0595
Echinococcus granulosus	sex peptide receptor	0.0091	0.0242	0.0242
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0091	0.0242	0.0595
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0091	0.0242	0.0242
Schistosoma mansoni	neuropeptide f receptor 76f	0.0091	0.0242	0.0595
Loa Loa (eye worm)	carboxylesterase	0.0415	0.3977	0.9784
Echinococcus multilocularis	sodium and chloride dependent glycine	0.0072	0.0019	0.0019
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0091	0.0242	0.0242
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0091	0.0242	0.0242
Echinococcus granulosus	rhodopsin orphan GPCR	0.0091	0.0242	0.0242
Echinococcus granulosus	G protein coupled receptor 139	0.0091	0.0242	0.0242
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0091	0.0242	0.0595
Echinococcus granulosus	7tm_1 domain containing protein	0.0091	0.0242	0.0242
Trichomonas vaginalis	carboxylesterase domain containing protein, putative	0.007	0	0.5
Toxoplasma gondii	1,3-beta-glucan synthase component protein	0.0247	0.2042	1
Chlamydia trachomatis	Ssodium-dependent amino acid transporter	0.0072	0.0019	0.5
Echinococcus multilocularis	g protein coupled receptor	0.0091	0.0242	0.0242
Loa Loa (eye worm)	neuropeptide F receptor	0.0091	0.0242	0.0595
Schistosoma mansoni	biogenic amine receptor	0.0091	0.0242	0.0595
Brugia malayi	neuropeptide F receptor	0.0091	0.0242	0.0427
Schistosoma mansoni	sodium/chloride dependent neurotransmitter transporter	0.0072	0.0019	0.0046
Onchocerca volvulus		0.0091	0.0242	0.0595
Echinococcus multilocularis	sodium and chloride dependent glycine	0.0072	0.0019	0.0019
Brugia malayi	larval opioid receptor	0.0091	0.0242	0.0427
Brugia malayi	hypothetical protein	0.0091	0.0242	0.0427
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0091	0.0242	0.0595
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0242	0.0595

Activities

Activity type	Activity value	Assay description	Source	Reference
Ki (binding)	= 0.4 nM	Competitive Inhibition Assay	BINDINGDB.	No reference
Ki (binding)	= 0.4 nM	Competitive Inhibition Assay Using [I125]-NDP-a-MSH	BINDINGDB.	No reference

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.

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External resources for this compound

ChEMBL: CHEMBL3646851

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1954429