TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 478.603 | Formula: C27H30N2O4S
H donors: 1 H acceptors: 4 LogP: 5.07 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: O=C(N1CCC1(C)C(=O)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)Cc1cccc2c1cccc2
InChi: 1S/C27H30N2O4S/c1-26(2,3)21-12-14-22(15-13-21)34(32,33)28-25(31)27(4)16-17-29(27)24(30)18-20-10-7-9-19-8-5-6-11-23(19)20/h5-15H,16-18H2,1-4H3,(H,28,31)
InChiKey: GMRXAFKIPGBBGH-UHFFFAOYSA-N

Network

Hover on a compound node to display the structore

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

This is a work in progress. Come back soon to try this features!

Clustering layers

This is a work in progress. Come back soon to try this features!

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	parathyroid hormone 1 receptor	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma japonicum	ko:K04588 secretin receptor, putative	Get druggable targets OG5_139196	All targets in OG5_139196

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
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0063	0.0515	0.0515
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0063	0.0515	0.0515
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Echinococcus multilocularis	fmrfamide receptor	0.0063	0.0515	0.0515
Brugia malayi	Glycosyl hydrolases family 31 protein	0.0162	0.2016	0.3093
Mycobacterium leprae	Probable fructose bisphosphate aldolase Fba	0.0142	0.171	0.2105
Schistosoma mansoni	neuropeptide receptor	0.0063	0.0515	0.0515
Echinococcus granulosus	rhodopsin orphan GPCR	0.0063	0.0515	0.0515
Brugia malayi	amidase	0.0457	0.6517	1
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Echinococcus multilocularis	orexin receptor type 2	0.0063	0.0515	0.0515
Schistosoma mansoni	neuropeptide receptor	0.0063	0.0515	0.0515
Echinococcus multilocularis	neuropeptide s receptor	0.0063	0.0515	0.0515
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0063	0.0515	0.0515
Brugia malayi	Dopamine receptor protein 1	0.0063	0.0515	0.079
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0063	0.0515	0.0515
Brugia malayi	Dopamine receptor	0.0063	0.0515	0.079
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Brugia malayi	hypothetical protein	0.0063	0.0515	0.079
Brugia malayi	Serotonin receptor	0.0063	0.0515	0.079
Echinococcus granulosus	G protein coupled receptor 139	0.0063	0.0515	0.0515
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0063	0.0515	0.079
Onchocerca volvulus		0.0063	0.0515	0.1643
Onchocerca volvulus		0.0063	0.0515	0.1643
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0063	0.0515	0.0515
Schistosoma mansoni	amine GPCR	0.0063	0.0515	0.0515
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0063	0.0515	0.0515
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Onchocerca volvulus		0.0063	0.0515	0.1643
Schistosoma mansoni	histamine h1 receptor	0.0063	0.0515	0.0515
Brugia malayi	Amidase family protein	0.0055	0.0389	0.0596
Brugia malayi	Pre-SET motif family protein	0.0207	0.27	0.4143
Echinococcus multilocularis	lysosomal alpha glucosidase	0.0162	0.2016	0.2016
Echinococcus granulosus	neuropeptide Y receptor	0.0063	0.0515	0.0515
Echinococcus granulosus	biogenic amine 5HT receptor	0.0063	0.0515	0.0515
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0063	0.0515	0.079
Brugia malayi	hypothetical protein	0.0063	0.0515	0.079
Brugia malayi	Dopamine receptor protein 2	0.0063	0.0515	0.079
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.029	0.3975	0.5901
Brugia malayi	G protein-coupled receptor F59B2.13	0.0063	0.0515	0.079
Schistosoma mansoni	amine GPCR	0.0063	0.0515	0.0515
Trichomonas vaginalis	conserved hypothetical protein	0.0467	0.6669	1
Schistosoma mansoni	opsin-like receptor	0.0063	0.0515	0.0515
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0063	0.0515	0.0515
Schistosoma mansoni	growth hormone secretagogue receptor	0.0063	0.0515	0.0515
Treponema pallidum	fructose-bisphosphate aldolase	0.029	0.3975	1
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0086	0.0855	0.1121
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0063	0.0515	0.0515
Echinococcus granulosus	neutral alpha glucosidase AB	0.0036	0.0095	0.0095
Loa Loa (eye worm)	jmjC domain-containing protein	0.006	0.046	0.0705
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.029	0.3975	0.5901
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0063	0.0515	0.0515
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0063	0.0515	0.0515
Onchocerca volvulus	Neuropeptide F receptor homolog	0.0063	0.0515	0.1643
Echinococcus multilocularis	glutamyl tRNA(Gln) amidotransferase subunit A	0.0055	0.0389	0.0389
Brugia malayi	G-protein coupled receptor	0.0063	0.0515	0.079
Echinococcus multilocularis	fatty acid amide hydrolase 1	0.0055	0.0389	0.0389
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0063	0.0515	0.0515
Brugia malayi	RE15519p	0.0063	0.0515	0.079
Echinococcus granulosus	jumonji domain containing protein	0.004	0.0162	0.0162
Schistosoma mansoni	alpha-glucosidase	0.0139	0.1672	0.1672
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0063	0.0515	0.0515
Brugia malayi	jmjC domain containing protein	0.0153	0.1885	0.2892
Leishmania major	trypanothione reductase	0.0038	0.0121	0.0039
Onchocerca volvulus		0.0063	0.0515	0.1643
Mycobacterium tuberculosis	Probable amidase AmiC (aminohydrolase)	0.0055	0.0389	0.0409
Echinococcus multilocularis	serotonin receptor	0.0063	0.0515	0.0515
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Entamoeba histolytica	hydrolase, alpha/beta fold family domain containing protein	0.0467	0.6669	1
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0095	0.1001	0.1344
Mycobacterium tuberculosis	Probable amidase AmiA2 (aminohydrolase)	0.0055	0.0389	0.0409
Echinococcus granulosus	fatty acid amide hydrolase 1	0.0457	0.6517	0.6517
Echinococcus granulosus	rhodopsin orphan GPCR	0.0063	0.0515	0.0515
Echinococcus multilocularis	g protein coupled receptor	0.0063	0.0515	0.0515
Brugia malayi	hypothetical protein	0.0063	0.0515	0.079
Brugia malayi	putative neuropeptide receptor NPR1	0.0063	0.0515	0.079
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Schistosoma mansoni	adenoreceptor	0.0063	0.0515	0.0515
Toxoplasma gondii	thioredoxin reductase	0.0038	0.0121	1
Loa Loa (eye worm)	neuropeptide F receptor	0.0063	0.0515	0.079
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Brugia malayi	glutathione reductase	0.0038	0.0121	0.0185
Brugia malayi	ORL1-like opioid receptor	0.0063	0.0515	0.079
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Mycobacterium tuberculosis	Probable reductase	0.0086	0.0855	0.1121
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.029	0.3975	0.5901
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Schistosoma mansoni	neuropeptide F-like receptor	0.0063	0.0515	0.0515
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0063	0.0515	0.079
Brugia malayi	hypothetical protein	0.0063	0.0515	0.079
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0063	0.0515	0.0515
Onchocerca volvulus		0.0063	0.0515	0.1643
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0063	0.0515	0.079
Echinococcus granulosus	allatostatin A receptor	0.0063	0.0515	0.0515
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0063	0.0515	0.0515
Echinococcus multilocularis	g-protein coupled receptor	0.0063	0.0515	0.0515
Echinococcus granulosus	tm gpcr rhodopsin	0.0063	0.0515	0.0515
Schistosoma mansoni	opsin-like receptor	0.0063	0.0515	0.0515
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0063	0.0515	0.079
Brugia malayi	AKH receptor	0.0063	0.0515	0.079
Trichomonas vaginalis	Clan SC, family S33, methylesterase-like serine peptidase	0.0467	0.6669	1
Onchocerca volvulus		0.0063	0.0515	0.1643
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Echinococcus multilocularis	dro:myosuppressin receptor	0.0063	0.0515	0.0515
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Echinococcus granulosus	neuropeptide receptor	0.0063	0.0515	0.0515
Onchocerca volvulus		0.0063	0.0515	0.1643
Echinococcus multilocularis	sex peptide receptor	0.0063	0.0515	0.0515
Wolbachia endosymbiont of Brugia malayi	aspartyl/glutamyl-tRNA amidotransferase subunit A	0.0055	0.0389	0.5
Loa Loa (eye worm)	thioredoxin reductase	0.0038	0.0121	0.0185
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0086	0.0855	0.1121
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0038	0.0128	0.0128
Brugia malayi	G-protein coupled receptor	0.0063	0.0515	0.079
Echinococcus granulosus	rhodopsin orphan GPCR	0.0063	0.0515	0.0515
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.029	0.3975	0.5901
Brugia malayi	neuropeptide F receptor	0.0063	0.0515	0.079
Echinococcus granulosus	g protein coupled receptor	0.0063	0.0515	0.0515
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Mycobacterium tuberculosis	Probable dehydrogenase	0.0086	0.0855	0.1121
Brugia malayi	Serotonin receptor	0.0063	0.0515	0.079
Loa Loa (eye worm)	jmjC domain-containing protein	0.0093	0.0973	0.1493
Echinococcus granulosus	neuropeptide FF receptor 2	0.0063	0.0515	0.0515
Echinococcus multilocularis	microtubule associated protein 2	0.0685	1	1
Brugia malayi	GnHR receptor homolog	0.0063	0.0515	0.079
Echinococcus granulosus	7tm_1 domain containing protein	0.0063	0.0515	0.0515
Echinococcus multilocularis	neuropeptide Y receptor	0.0063	0.0515	0.0515
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Echinococcus granulosus	orexin receptor type 2	0.0063	0.0515	0.0515
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0063	0.0515	0.0515
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0207	0.27	0.4143
Schistosoma mansoni	biogenic amine receptor	0.0063	0.0515	0.0515
Echinococcus multilocularis	neuropeptide receptor A26	0.0063	0.0515	0.0515
Onchocerca volvulus		0.0094	0.0975	0.311
Echinococcus multilocularis	neuropeptides capa receptor	0.0063	0.0515	0.0515
Echinococcus multilocularis	jumonji domain containing protein	0.004	0.0162	0.0162
Trypanosoma brucei	monoglyceride lipase, putative	0.0467	0.6669	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0063	0.0515	0.0515
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0063	0.0515	0.0515
Echinococcus granulosus	lysosomal alpha glucosidase	0.0162	0.2016	0.2016
Brugia malayi	G protein-coupled receptor	0.0063	0.0515	0.079
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0176	0.0269
Trypanosoma cruzi	amidase, putative	0.0055	0.0389	0.0446
Trypanosoma brucei	monoglyceride lipase, putative	0.0467	0.6669	1
Schistosoma mansoni	fatty-acid amide hydrolase	0.0055	0.0389	0.0389
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.029	0.3975	0.5901
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.029	0.3975	0.5901
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Echinococcus granulosus	rhodopsin orphan GPCR	0.0063	0.0515	0.0515
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0063	0.0515	0.0515
Echinococcus granulosus	lysine specific demethylase 5A	0.0093	0.0973	0.0973
Schistosoma mansoni	alpha glucosidase	0.0036	0.0095	0.0095
Schistosoma mansoni	glutamyl-tRNA(Gln) amidotransferase subunit A	0.0055	0.0389	0.0389
Trypanosoma cruzi	trypanothione reductase, putative	0.0038	0.0121	0.0039
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Echinococcus multilocularis	neuropeptide receptor	0.0063	0.0515	0.0515
Echinococcus multilocularis	g protein coupled receptor	0.0063	0.0515	0.0515
Echinococcus granulosus	hypothetical protein	0.0063	0.0515	0.0515
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0063	0.0515	0.0515
Echinococcus multilocularis	neuropeptide Y receptor	0.0063	0.0515	0.0515
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0063	0.0515	0.0515
Echinococcus granulosus	serotonin receptor	0.0063	0.0515	0.0515
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0063	0.0515	0.0515
Loa Loa (eye worm)	amidase	0.0055	0.0389	0.0596
Onchocerca volvulus		0.0063	0.0515	0.1643
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0063	0.0515	0.0515
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.006	0.0466	0.0715
Echinococcus multilocularis	serotonin receptor	0.0063	0.0515	0.0515
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0063	0.0515	0.0515
Brugia malayi	hypothetical protein	0.0063	0.0515	0.079
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.029	0.3975	0.5901
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.029	0.3975	0.5901
Brugia malayi	sulfakinin receptor protein	0.0063	0.0515	0.079
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Schistosoma mansoni	neuropeptide F-like receptor	0.0063	0.0515	0.0515
Onchocerca volvulus		0.0063	0.0515	0.1643
Echinococcus granulosus	fmrfamide receptor	0.0063	0.0515	0.0515
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Toxoplasma gondii	glycosyl hydrolase, family 31 protein	0.0036	0.0095	0.79
Schistosoma mansoni	amine GPCR	0.0063	0.0515	0.0515
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Echinococcus granulosus	rhodopsin orphan GPCR	0.0063	0.0515	0.0515
Schistosoma mansoni	myosin xvIII	0.0063	0.0515	0.0515
Brugia malayi	Amidase family protein	0.0055	0.0389	0.0596
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Plasmodium vivax	glutathione reductase, putative	0.0038	0.0121	0.0181
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0063	0.0515	0.079
Echinococcus multilocularis	somatostatin receptor	0.0063	0.0515	0.0515
Echinococcus granulosus	glutamyl tRNAGln amidotransferase subunit A	0.0055	0.0389	0.0389
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Mycobacterium ulcerans	hypothetical protein	0.0467	0.6669	1
Onchocerca volvulus		0.0063	0.0515	0.1643
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.0063	0.0515	0.079
Onchocerca volvulus		0.0063	0.0515	0.1643
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0063	0.0515	0.0515
Onchocerca volvulus		0.0063	0.0515	0.1643
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0063	0.0515	0.0515
Onchocerca volvulus		0.0063	0.0515	0.1643
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0063	0.0515	0.0515
Echinococcus granulosus	neuropeptide receptor A26	0.0063	0.0515	0.0515
Trichomonas vaginalis	Clan SC, family S33, methylesterase-like serine peptidase	0.0467	0.6669	1
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0063	0.0515	0.0515
Onchocerca volvulus	Dopamine\/Ecdysteroid receptor homolog	0.0063	0.0515	0.1643
Mycobacterium tuberculosis	Possible lysophospholipase	0.0467	0.6669	1
Echinococcus multilocularis	lysine specific demethylase 5A	0.0093	0.0973	0.0973
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Echinococcus granulosus	rhodopsin orphan GPCR	0.0063	0.0515	0.0515
Schistosoma mansoni	amidase	0.0457	0.6517	0.6517
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0063	0.0515	0.0515
Brugia malayi	hypothetical protein	0.0063	0.0515	0.079
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0063	0.0515	0.079
Entamoeba histolytica	hydrolase, alpha/beta fold family domain containing protein	0.0467	0.6669	1
Schistosoma mansoni	hypothetical protein	0.0063	0.0515	0.0515
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0063	0.0515	0.079
Echinococcus multilocularis	G protein coupled receptor 139	0.0063	0.0515	0.0515
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0063	0.0515	0.0515
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0063	0.0515	0.0515
Echinococcus granulosus	neuropeptides capa receptor	0.0063	0.0515	0.0515
Schistosoma mansoni	hypothetical protein	0.0041	0.0176	0.0176
Schistosoma mansoni	jumonji domain containing protein	0.0134	0.1588	0.1588
Loa Loa (eye worm)	glycosyl hydrolase family 31 protein	0.0036	0.0095	0.0146
Echinococcus granulosus	rhodopsin orphan GPCR	0.0063	0.0515	0.0515
Schistosoma mansoni	hypothetical protein	0.0063	0.0515	0.0515
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0063	0.0515	0.0515
Schistosoma mansoni	hypothetical protein	0.0063	0.0515	0.0515
Echinococcus granulosus	thioredoxin glutathione reductase	0.0038	0.0128	0.0128
Brugia malayi	hypothetical protein	0.0063	0.0515	0.079
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0063	0.0515	0.0515
Leishmania major	hypothetical protein, conserved	0.0055	0.0389	0.0446
Loa Loa (eye worm)	hypothetical protein	0.0065	0.0542	0.0832
Plasmodium falciparum	lysophospholipase, putative	0.0467	0.6669	1
Echinococcus granulosus	biogenic amine 5HT receptor	0.0063	0.0515	0.0515
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.0063	0.0515	0.079
Loa Loa (eye worm)	amidase	0.0055	0.0389	0.0596
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0063	0.0515	0.0515
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0063	0.0515	0.0515
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0095	0.1001	0.0975
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0063	0.0515	0.0515
Trypanosoma brucei	fatty-acid amide hydrolase, putative	0.0055	0.0389	0.0446
Mycobacterium tuberculosis	Probable amidase AmiB2 (aminohydrolase)	0.0055	0.0389	0.0409
Loa Loa (eye worm)	G-protein coupled receptor	0.0063	0.0515	0.079
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0063	0.0515	0.0515
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.029	0.3975	0.5901
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0063	0.0515	0.0515
Echinococcus granulosus	7TM GPCR rhodopsin	0.0063	0.0515	0.0515
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0063	0.0515	0.0515
Echinococcus multilocularis	fmrfamide receptor	0.0063	0.0515	0.0515
Mycobacterium ulcerans	fructose-bisphosphate aldolase	0.0142	0.171	0.2105
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Echinococcus multilocularis	Transcription factor, JmjC domain containing protein	0.0153	0.1885	0.1885
Mycobacterium leprae	POSSIBLE LYSOPHOSPHOLIPASE	0.0467	0.6669	1
Schistosoma mansoni	neuropeptide receptor	0.0063	0.0515	0.0515
Trichomonas vaginalis	valacyclovir hydrolase, putative	0.0467	0.6669	1
Echinococcus granulosus	g protein coupled receptor	0.0063	0.0515	0.0515
Loa Loa (eye worm)	glutathione reductase	0.0038	0.0121	0.0185
Schistosoma mansoni	biogenic amine receptor	0.0063	0.0515	0.0515
Trichomonas vaginalis	Clan SC, family S33, methylesterase-like serine peptidase	0.0467	0.6669	1
Echinococcus granulosus	dro:myosuppressin receptor	0.0063	0.0515	0.0515
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0063	0.0515	0.0515
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0093	0.0973	0.0973
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.029	0.3975	0.5901
Mycobacterium tuberculosis	Probable oxidoreductase	0.0095	0.1001	0.1344
Plasmodium vivax	thioredoxin reductase, putative	0.0038	0.0121	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Loa Loa (eye worm)	melatonin receptor type 1A	0.0063	0.0515	0.079
Brugia malayi	Melatonin receptor type 1A	0.0063	0.0515	0.079
Trichomonas vaginalis	Clan SC, family S33, methylesterase-like serine peptidase	0.0467	0.6669	1
Echinococcus granulosus	neuropeptide receptor	0.0063	0.0515	0.0515
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Onchocerca volvulus		0.0063	0.0515	0.1643
Echinococcus granulosus	neuropeptides capa receptor	0.0063	0.0515	0.0515
Schistosoma mansoni	neuropeptide receptor	0.0063	0.0515	0.0515
Schistosoma mansoni	fatty-acid amide hydrolase	0.0457	0.6517	0.6517
Trypanosoma cruzi	monoglyceride lipase, putative	0.0467	0.6669	1
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0063	0.0515	0.0515
Plasmodium falciparum	lysophospholipase, putative	0.0467	0.6669	1
Echinococcus multilocularis	neutral alpha glucosidase AB	0.0036	0.0095	0.0095
Mycobacterium tuberculosis	Probable amidase AmiD (acylamidase) (acylase)	0.0055	0.0389	0.0409
Plasmodium vivax	glutamyl-tRNA(Gln) amidotransferase subunit A, putative	0.0055	0.0389	0.0583
Echinococcus granulosus	tm gpcr rhodopsin	0.0063	0.0515	0.0515
Mycobacterium tuberculosis	Probable fructose-bisphosphate aldolase Fba	0.0142	0.171	0.2428
Echinococcus multilocularis	lysosomal alpha glucosidase	0.0162	0.2016	0.2016
Plasmodium falciparum	esterase, putative	0.0467	0.6669	1
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Brugia malayi	neuropeptide F receptor	0.0063	0.0515	0.079
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0063	0.0515	0.0515
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0063	0.0515	0.0515
Mycobacterium leprae	PROBABLE NADH DEHYDROGENASE NDH	0.0086	0.0855	0.0742
Loa Loa (eye worm)	TYRA-2 protein	0.0063	0.0515	0.079
Schistosoma mansoni	amine GPCR	0.0063	0.0515	0.0515
Brugia malayi	Thioredoxin reductase	0.0038	0.0121	0.0185
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Trypanosoma brucei	trypanothione reductase	0.0038	0.0121	0.0039
Brugia malayi	putative neuropeptide receptor	0.0063	0.0515	0.079
Echinococcus multilocularis	fatty acid amide hydrolase 1	0.0457	0.6517	0.6517
Trichomonas vaginalis	set domain proteins, putative	0.0235	0.3136	0.4625
Echinococcus granulosus	tm gpcr rhodopsin	0.0063	0.0515	0.0515
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0063	0.0515	0.0515
Onchocerca volvulus		0.0063	0.0515	0.1643
Brugia malayi	Calcitonin receptor-like protein seb-1	0.006	0.0466	0.0715
Brugia malayi	hypothetical protein	0.0063	0.0515	0.079
Brugia malayi	follicle stimulating hormone receptor	0.0063	0.0515	0.079
Echinococcus granulosus	g-protein coupled receptor	0.0063	0.0515	0.0515
Echinococcus granulosus	fatty acid amide hydrolase 1	0.0457	0.6517	0.6517
Echinococcus granulosus	sex peptide receptor	0.0063	0.0515	0.0515
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0063	0.0515	0.0515
Onchocerca volvulus		0.0235	0.3136	1
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Schistosoma mansoni	alpha-glucosidase	0.0139	0.1672	0.1672
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0063	0.0515	0.0515
Onchocerca volvulus		0.0063	0.0515	0.1643
Loa Loa (eye worm)	glycosyl hydrolase family 31 protein	0.0162	0.2016	0.3093
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0093	0.0973	0.0973
Chlamydia trachomatis	glutamyl-tRNA(Gln) amidotransferase subunit A	0.0055	0.0389	0.5
Loa Loa (eye worm)	neuropeptide F receptor	0.0063	0.0515	0.079
Schistosoma mansoni	amine GPCR	0.0063	0.0515	0.0515
Schistosoma mansoni	biogenic amine receptor	0.0063	0.0515	0.0515
Echinococcus multilocularis	allatostatin A receptor	0.0063	0.0515	0.0515
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0063	0.0515	0.0515
Leishmania major	monoglyceride lipase, putative	0.0467	0.6669	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0063	0.0515	0.0515
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Brugia malayi	larval opioid receptor	0.0063	0.0515	0.079
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0063	0.0515	0.0515
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Plasmodium vivax	PST-A protein	0.0467	0.6669	1
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0063	0.0515	0.0515
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Echinococcus granulosus	fatty acid amide hydrolase 1	0.0055	0.0389	0.0389
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0063	0.0515	0.0515
Echinococcus multilocularis	g protein coupled receptor	0.0063	0.0515	0.0515
Brugia malayi	hypothetical protein	0.0063	0.0515	0.079
Trichomonas vaginalis	Clan SC, family S33, methylesterase-like serine peptidase	0.0467	0.6669	1
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0095	0.1001	0.1344
Brugia malayi	jmjC domain containing protein	0.0093	0.0973	0.1493
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0086	0.0855	0.1121
Plasmodium falciparum	glutamyl-tRNA(Gln) amidotransferase subunit A	0.0055	0.0389	0.0409
Schistosoma mansoni	microtubule-associated protein tau	0.0685	1	1
Brugia malayi	Glycosyl hydrolases family 31 protein	0.0036	0.0095	0.0146
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.006	0.0466	0.0715
Loa Loa (eye worm)	G-protein coupled receptor	0.0063	0.0515	0.079
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Onchocerca volvulus		0.0063	0.0515	0.1643
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0063	0.0515	0.0515
Echinococcus multilocularis	neuropeptide receptor	0.0063	0.0515	0.0515
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0063	0.0515	0.0515
Brugia malayi	latrophilin 2 splice variant baaae	0.0041	0.0176	0.0269
Schistosoma mansoni	hypothetical protein	0.0063	0.0515	0.0515
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0063	0.0515	0.079
Trichomonas vaginalis	conserved hypothetical protein	0.0467	0.6669	1
Echinococcus multilocularis	neuropeptides capa receptor	0.0063	0.0515	0.0515
Schistosoma mansoni	neuropeptide f receptor 76f	0.0063	0.0515	0.0515
Echinococcus multilocularis	fatty acid amide hydrolase 1	0.0457	0.6517	0.6517
Loa Loa (eye worm)	hypothetical protein	0.006	0.0466	0.0715
Echinococcus granulosus	neuropeptide Y receptor	0.0063	0.0515	0.0515
Brugia malayi	putative amidase	0.0055	0.0389	0.0596
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0063	0.0515	0.0515
Brugia malayi	hypothetical protein	0.0063	0.0515	0.079
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0063	0.0515	0.0515
Plasmodium falciparum	lysophospholipase, putative	0.0467	0.6669	1
Echinococcus granulosus	Transcription factor JmjC domain containing protein	0.0153	0.1885	0.1885
Loa Loa (eye worm)	hypothetical protein	0.0457	0.6517	1
Mycobacterium ulcerans	lysophospholipase	0.0467	0.6669	1
Schistosoma mansoni	opsin-like receptor	0.0063	0.0515	0.0515
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0086	0.0855	0.1121
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0063	0.0515	0.0515
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0515	0.079
Trypanosoma cruzi	amidase, putative	0.0055	0.0389	0.0446
Mycobacterium tuberculosis	Possible amidase (aminohydrolase)	0.0055	0.0389	0.0409
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0063	0.0515	0.0515
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0063	0.0515	0.0515
Echinococcus granulosus	g protein coupled receptor	0.0063	0.0515	0.0515
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0063	0.0515	0.0515
Giardia lamblia	Fructose-bisphosphate aldolase	0.029	0.3975	0.5
Echinococcus granulosus	somatostatin receptor	0.0063	0.0515	0.0515
Echinococcus granulosus	neuropeptide s receptor	0.0063	0.0515	0.0515

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	15.8489 uM	PubChem BioAssay. qHTS of PTHR Inhibitors: Primary Screen. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	35.4813 uM	PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	67.0158 uM	PubChem BioAssay. qHTS for Inhibitors of PLK1-PDB (polo-like kinase 1 - polo-box domain): Primary Screen. (Class of assay: confirmatory)	ChEMBL.	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.

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: CHEMBL2357929

Bibliographic References

No literature references available for this target.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 1757165