TDR Targets

Basic information

Technical information

TDR Targets ID: 451055
Name: 1-(2-dimethylaminoethyl)-3-(2-ethylphenyl)-1- (thiophen-2-ylmethyl)thiourea
MW: 347.541 | Formula: C18H25N3S2
H donors: 1 H acceptors: 0 LogP: 3.75 Rotable bonds: 9
Rule of 5 violations (Lipinski): 1
SMILES: CCc1ccccc1NC(=S)N(Cc1cccs1)CCN(C)C
InChi: 1S/C18H25N3S2/c1-4-15-8-5-6-10-17(15)19-18(22)21(12-11-20(2)3)14-16-9-7-13-23-16/h5-10,13H,4,11-12,14H2,1-3H3,(H,19,22)
InChiKey: RERSMSAEQKQWGT-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

1-(2-dimethylaminoethyl)-3-(2-ethylphenyl)-1-(2-thienylmethyl)thiourea
1-(2-dimethylaminoethyl)-3-(2-ethylphenyl)-1-(2-thenyl)thiourea
ChemDiv3_007681
IDI1_025591
MLS000729707
N-[2-(dimethylamino)ethyl]-N'-(2-ethylphenyl)-N-(thien-2-ylmethyl)thiourea
SMR000307984

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Mus musculus	RAR-related orphan receptor gamma	Starlite/ChEMBL	No references
Homo sapiens	nuclear factor, erythroid 2-like 2	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	Melatonin receptor type 1A	0.0108	0.1045	0.1765
Loa Loa (eye worm)	neuropeptide F receptor	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Echinococcus multilocularis	fmrfamide receptor	0.0108	0.1045	0.1765
Schistosoma mansoni	amine GPCR	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0108	0.1045	0.1765
Echinococcus granulosus	neuropeptide s receptor	0.0108	0.1045	0.1765
Brugia malayi	hypothetical protein	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0108	0.1045	0.1765
Echinococcus multilocularis	somatostatin receptor	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0108	0.1045	0.1765
Echinococcus granulosus	biogenic amine 5HT receptor	0.0108	0.1045	0.1765
Echinococcus multilocularis	neuropeptide Y receptor	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Schistosoma mansoni	neuropeptide F-like receptor	0.0108	0.1045	0.1765
Echinococcus multilocularis	serotonin receptor	0.0108	0.1045	0.1765
Brugia malayi	hypothetical protein	0.0108	0.1045	0.1765
Schistosoma mansoni	amine GPCR	0.0108	0.1045	0.1765
Echinococcus multilocularis	serotonin receptor	0.0108	0.1045	0.1765
Schistosoma mansoni	biogenic amine receptor	0.0108	0.1045	0.1765
Echinococcus granulosus	G protein coupled receptor 139	0.0108	0.1045	0.1765
Brugia malayi	sulfakinin receptor protein	0.0108	0.1045	0.1765
Schistosoma mansoni	amine GPCR	0.0108	0.1045	0.1765
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0108	0.1045	0.1765
Brugia malayi	thymidylate synthase	0.021	0.5922	1
Schistosoma mansoni	biogenic amine receptor	0.0108	0.1045	0.1765
Trichomonas vaginalis	conserved hypothetical protein	0.01	0.068	0.5
Echinococcus granulosus	dro:myosuppressin receptor	0.0108	0.1045	0.1765
Brugia malayi	putative neuropeptide receptor	0.0108	0.1045	0.1765
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0108	0.1045	0.1765
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Brugia malayi	G-protein coupled receptor	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Echinococcus granulosus	g protein coupled receptor	0.0108	0.1045	0.1765
Schistosoma mansoni	neuropeptide f receptor 76f	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0108	0.1045	0.1765
Echinococcus granulosus	rhodopsin orphan GPCR	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0108	0.1045	0.1765
Echinococcus multilocularis	g protein coupled receptor	0.0108	0.1045	0.1765
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Schistosoma mansoni	biogenic amine receptor	0.0108	0.1045	0.1765
Echinococcus multilocularis	dro:myosuppressin receptor	0.0108	0.1045	0.1765
Loa Loa (eye worm)	G-protein coupled receptor	0.0108	0.1045	0.1765
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Schistosoma mansoni	hypothetical protein	0.0108	0.1045	0.1765
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0108	0.1045	0.1765
Echinococcus granulosus	neuropeptides capa receptor	0.0108	0.1045	0.1765
Schistosoma mansoni	bifunctional dihydrofolate reductase-thymidylate synthase	0.021	0.5922	1
Echinococcus multilocularis	neuropeptide s receptor	0.0108	0.1045	0.1765
Echinococcus granulosus	g protein coupled receptor	0.0108	0.1045	0.1765
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0108	0.1045	0.1765
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0108	0.1045	0.1765
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0108	0.1045	0.1765
Echinococcus granulosus	neuropeptide Y receptor	0.0108	0.1045	0.1765
Schistosoma mansoni	amine GPCR	0.0108	0.1045	0.1765
Echinococcus multilocularis	fmrfamide receptor	0.0108	0.1045	0.1765
Schistosoma mansoni	amine GPCR	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Schistosoma mansoni	opsin-like receptor	0.0108	0.1045	0.1765
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0108	0.1045	0.1765
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0108	0.1045	0.1765
Mycobacterium tuberculosis	Hypothetical protein	0.01	0.068	0.1148
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0108	0.1045	0.1765
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Plasmodium vivax	bifunctional dihydrofolate reductase-thymidylate synthase, putative	0.0296	1	0.5
Mycobacterium tuberculosis	Probable thymidylate synthase ThyA (ts) (TSASE)	0.021	0.5922	1
Echinococcus multilocularis	g protein coupled receptor	0.0108	0.1045	0.1765
Loa Loa (eye worm)	TYRA-2 protein	0.0108	0.1045	0.1765
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0108	0.1045	0.1765
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0108	0.1045	0.1765
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0108	0.1045	0.1765
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Echinococcus multilocularis	neuropeptide receptor	0.0108	0.1045	0.1765
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0108	0.1045	0.1765
Echinococcus multilocularis	g protein coupled receptor	0.0108	0.1045	0.1765
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Mycobacterium ulcerans	thymidylate synthase	0.021	0.5922	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0108	0.1045	0.1765
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0108	0.1045	0.1765
Schistosoma mansoni	hypothetical protein	0.0108	0.1045	0.1765
Echinococcus granulosus	somatostatin receptor	0.0108	0.1045	0.1765
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0108	0.1045	0.1765
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0108	0.1045	0.1765
Brugia malayi	neuropeptide F receptor	0.0108	0.1045	0.1765
Echinococcus granulosus	tm gpcr rhodopsin	0.0108	0.1045	0.1765
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0108	0.1045	0.1765
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0108	0.1045	0.1765
Schistosoma mansoni	myosin xvIII	0.0108	0.1045	0.1765
Brugia malayi	larval opioid receptor	0.0108	0.1045	0.1765
Schistosoma mansoni	neuropeptide receptor	0.0108	0.1045	0.1765
Brugia malayi	follicle stimulating hormone receptor	0.0108	0.1045	0.1765
Brugia malayi	hypothetical protein	0.0108	0.1045	0.1765
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0108	0.1045	0.1765
Schistosoma mansoni	hypothetical protein	0.0108	0.1045	0.1765
Brugia malayi	AKH receptor	0.0108	0.1045	0.1765
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0108	0.1045	0.1765
Echinococcus multilocularis	neuropeptides capa receptor	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Brugia malayi	Serotonin receptor	0.0108	0.1045	0.1765
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0108	0.1045	0.1765
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0108	0.1045	0.1765
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0108	0.1045	0.1765
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Schistosoma mansoni	neuropeptide F-like receptor	0.0108	0.1045	0.1765
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.0108	0.1045	0.1765
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Brugia malayi	Serotonin receptor	0.0108	0.1045	0.1765
Echinococcus multilocularis	orexin receptor type 2	0.0108	0.1045	0.1765
Brugia malayi	hypothetical protein	0.0108	0.1045	0.1765
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0108	0.1045	0.1765
Echinococcus granulosus	7tm_1 domain containing protein	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Schistosoma mansoni	neuropeptide receptor	0.0108	0.1045	0.1765
Brugia malayi	G protein-coupled receptor	0.0108	0.1045	0.1765
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0108	0.1045	0.1765
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0108	0.1045	0.1765
Schistosoma mansoni	hypothetical protein	0.0108	0.1045	0.1765
Echinococcus multilocularis	thymidylate synthase	0.021	0.5922	1
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Schistosoma mansoni	neuropeptide receptor	0.0108	0.1045	0.1765
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0108	0.1045	0.1765
Echinococcus granulosus	neuropeptide receptor A26	0.0108	0.1045	0.1765
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Onchocerca volvulus		0.021	0.5922	1
Echinococcus multilocularis	neuropeptide Y receptor	0.0108	0.1045	0.1765
Toxoplasma gondii	bifunctional dihydrofolate reductase-thymidylate synthase	0.0296	1	0.5
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Echinococcus granulosus	rhodopsin orphan GPCR	0.0108	0.1045	0.1765
Brugia malayi	RE15519p	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0108	0.1045	0.1765
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0108	0.1045	0.1765
Echinococcus multilocularis	neuropeptides capa receptor	0.0108	0.1045	0.1765
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0108	0.1045	0.1765
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0108	0.1045	0.1765
Echinococcus granulosus	rhodopsin orphan GPCR	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Echinococcus granulosus	rhodopsin orphan GPCR	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Schistosoma mansoni	opsin-like receptor	0.0108	0.1045	0.1765
Echinococcus granulosus	fmrfamide receptor	0.0108	0.1045	0.1765
Brugia malayi	Dopamine receptor protein 1	0.0108	0.1045	0.1765
Mycobacterium leprae	PROBABLE THYMIDYLATE SYNTHASE THYA (TS) (TSASE)	0.021	0.5922	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.0108	0.1045	0.1765
Echinococcus granulosus	orexin receptor type 2	0.0108	0.1045	0.1765
Brugia malayi	hypothetical protein	0.0108	0.1045	0.1765
Echinococcus granulosus	neuropeptides capa receptor	0.0108	0.1045	0.1765
Echinococcus granulosus	g protein coupled receptor	0.0108	0.1045	0.1765
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0108	0.1045	0.1765
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0108	0.1045	0.1765
Schistosoma mansoni	opsin-like receptor	0.0108	0.1045	0.1765
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0108	0.1045	0.1765
Schistosoma mansoni	adenoreceptor	0.0108	0.1045	0.1765
Loa Loa (eye worm)	melatonin receptor type 1A	0.0108	0.1045	0.1765
Brugia malayi	putative neuropeptide receptor NPR1	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Echinococcus granulosus	tm gpcr rhodopsin	0.0108	0.1045	0.1765
Echinococcus multilocularis	g-protein coupled receptor	0.0108	0.1045	0.1765
Loa Loa (eye worm)	thymidylate synthase	0.021	0.5922	1
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0108	0.1045	0.1765
Brugia malayi	hypothetical protein	0.0108	0.1045	0.1765
Echinococcus multilocularis	neuropeptide receptor	0.0108	0.1045	0.1765
Plasmodium falciparum	bifunctional dihydrofolate reductase-thymidylate synthase	0.0296	1	0.5
Brugia malayi	GnHR receptor homolog	0.0108	0.1045	0.1765
Echinococcus granulosus	tm gpcr rhodopsin	0.0108	0.1045	0.1765
Brugia malayi	hypothetical protein	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0108	0.1045	0.1765
Schistosoma mansoni	neuropeptide receptor	0.0108	0.1045	0.1765
Echinococcus granulosus	hypothetical protein	0.0108	0.1045	0.1765
Schistosoma mansoni	growth hormone secretagogue receptor	0.0108	0.1045	0.1765
Brugia malayi	Dopamine receptor	0.0108	0.1045	0.1765
Brugia malayi	Dopamine receptor protein 2	0.0108	0.1045	0.1765
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0108	0.1045	0.1765
Brugia malayi	hypothetical protein	0.0108	0.1045	0.1765
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0108	0.1045	0.1765
Echinococcus granulosus	rhodopsin orphan GPCR	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Loa Loa (eye worm)	neuropeptide F receptor	0.0108	0.1045	0.1765
Trypanosoma cruzi	dihydrofolate reductase-thymidylate synthase	0.0296	1	1
Chlamydia trachomatis	dihydrofolate reductase	0.0086	0	0.5
Brugia malayi	G protein-coupled receptor F59B2.13	0.0108	0.1045	0.1765
Echinococcus granulosus	neuropeptide FF receptor 2	0.0108	0.1045	0.1765
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Brugia malayi	hypothetical protein	0.01	0.068	0.1148
Trypanosoma brucei	dihydrofolate reductase-thymidylate synthase	0.0296	1	0.5
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0108	0.1045	0.1765
Echinococcus granulosus	rhodopsin orphan GPCR	0.0108	0.1045	0.1765
Echinococcus granulosus	g-protein coupled receptor	0.0108	0.1045	0.1765
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0108	0.1045	0.1765
Echinococcus granulosus	neuropeptide receptor	0.0108	0.1045	0.1765
Echinococcus granulosus	allatostatin A receptor	0.0108	0.1045	0.1765
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0108	0.1045	0.1765
Brugia malayi	hypothetical protein	0.0108	0.1045	0.1765
Echinococcus multilocularis	allatostatin A receptor	0.0108	0.1045	0.1765
Echinococcus granulosus	neuropeptide receptor	0.0108	0.1045	0.1765
Echinococcus multilocularis	neuropeptide receptor A26	0.0108	0.1045	0.1765
Brugia malayi	hypothetical protein	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Echinococcus granulosus	sex peptide receptor	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Echinococcus granulosus	7TM GPCR rhodopsin	0.0108	0.1045	0.1765
Echinococcus granulosus	biogenic amine 5HT receptor	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Echinococcus multilocularis	sex peptide receptor	0.0108	0.1045	0.1765
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0108	0.1045	0.1765
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0108	0.1045	0.1765
Echinococcus granulosus	serotonin receptor	0.0108	0.1045	0.1765
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0108	0.1045	0.1765
Brugia malayi	G-protein coupled receptor	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0108	0.1045	0.1765
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0108	0.1045	0.1765
Echinococcus granulosus	neuropeptide Y receptor	0.0108	0.1045	0.1765
Schistosoma mansoni	histamine h1 receptor	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Echinococcus multilocularis	G protein coupled receptor 139	0.0108	0.1045	0.1765
Brugia malayi	neuropeptide F receptor	0.0108	0.1045	0.1765
Echinococcus granulosus	thymidylate synthase	0.021	0.5922	1
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.0108	0.1045	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1045	0.1765
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0108	0.1045	0.1765
Loa Loa (eye worm)	G-protein coupled receptor	0.0108	0.1045	0.1765
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0108	0.1045	0.1765
Brugia malayi	ORL1-like opioid receptor	0.0108	0.1045	0.1765

Activities

Activity type	Activity value	Assay description	Source	Reference
Activity (functional)	= 108.4 %	Inhibition of transthyretin amyloidosis assessed as fibril formation pH 4.4 at 100 uM	ChEMBL.	17948976
Activity (functional)	= 108.4 %	Inhibition of transthyretin amyloidosis assessed as fibril formation pH 4.4 at 100 uM	ChEMBL.	17948976
Inhibition (functional)	= 0 %	Inhibition of transthyretin fibril formation at pH 4.4 at 100 uM	ChEMBL.	17948976
Inhibition (functional)	= 0 %	Inhibition of transthyretin fibril formation at pH 4.4 at 100 uM	ChEMBL.	17948976
Potency (functional)	7.3078 uM	PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648]	ChEMBL.	No reference
Potency (functional)	= 11.2202 um	PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	13.1154 uM	PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference
Potency (functional)	28.1838 uM	PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	36.6108 uM	PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125]	ChEMBL.	No reference
Potency (functional)	89.1251 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623]	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Plasmodium falciparum	ChEMBL23

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: CHEMBL239270
PubChem: 4600984
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Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 451055