TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 368.259 | Formula: C20H15Cl2N3
H donors: 1 H acceptors: 1 LogP: 5.57 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: Clc1cc(ccc1Cl)Cn1c(N)nc2c1c(ccc2)c1ccccc1
InChi: 1S/C20H15Cl2N3/c21-16-10-9-13(11-17(16)22)12-25-19-15(14-5-2-1-3-6-14)7-4-8-18(19)24-20(25)23/h1-11H,12H2,(H2,23,24)
InChiKey: JFVMZMBFRZPOFF-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

Species	Target name	Source	Bibliographic reference
Trypanosoma brucei	pteridine reductase 1	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Leishmania major	pteridine reductase 1	Get druggable targets OG5_133937	All targets in OG5_133937
Trypanosoma brucei	pteridine reductase 1	Get druggable targets OG5_133937	All targets in OG5_133937
Leishmania donovani	pteridine reductase 1	Get druggable targets OG5_133937	All targets in OG5_133937
Leishmania mexicana	pteridine reductase 1	Get druggable targets OG5_133937	All targets in OG5_133937
Trypanosoma congolense	pteridine reductase 1	Get druggable targets OG5_133937	All targets in OG5_133937
Leishmania braziliensis	pteridine reductase 1	Get druggable targets OG5_133937	All targets in OG5_133937
Leishmania infantum	pteridine reductase 1	Get druggable targets OG5_133937	All targets in OG5_133937

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Plasmodium falciparum	3-oxoacyl-[acyl-carrier-protein] reductase	pteridine reductase 1	268 aa	267 aa	28.5 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Onchocerca volvulus		0.0033	0.0183	0.5
Brugia malayi	GnHR receptor homolog	0.0033	0.0183	0.1481
Schistosoma mansoni	hypothetical protein	0.0033	0.0183	0.0998
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Schistosoma mansoni	neuropeptide receptor	0.0033	0.0183	0.0998
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0101	0.0932	0.5084
Brugia malayi	hypothetical protein	0.0027	0.0113	0.091
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0053	0.0407	0.3289
Echinococcus granulosus	neuropeptide FF receptor 2	0.0033	0.0183	0.0998
Onchocerca volvulus		0.0033	0.0183	0.5
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0033	0.0183	0.0998
Schistosoma mansoni	hypothetical protein	0.0036	0.0218	0.1191
Brugia malayi	G protein-coupled receptor F59B2.13	0.0033	0.0183	0.1481
Schistosoma mansoni	neuropeptide f receptor 76f	0.0033	0.0183	0.0998
Schistosoma mansoni	growth hormone secretagogue receptor	0.0033	0.0183	0.0998
Echinococcus granulosus	neuropeptides capa receptor	0.0033	0.0183	0.0998
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Onchocerca volvulus		0.0033	0.0183	0.5
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Loa Loa (eye worm)	MH2 domain-containing protein	0.0128	0.1236	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0033	0.0183	0.0183
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Brugia malayi	hypothetical protein	0.0033	0.0183	0.1481
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0033	0.0183	0.0998
Onchocerca volvulus		0.0033	0.0183	0.5
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0033	0.0183	0.0183
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0033	0.0183	0.0998
Echinococcus granulosus	7tm_1 domain containing protein	0.0033	0.0183	0.0998
Echinococcus granulosus	allatostatin A receptor	0.0033	0.0183	0.0998
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0113	0.091
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0033	0.0183	0.0998
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0033	0.0183	0.1481
Onchocerca volvulus	Neuropeptide F receptor homolog	0.0033	0.0183	0.5
Brugia malayi	hypothetical protein	0.0033	0.0183	0.1481
Schistosoma mansoni	neuropeptide F-like receptor	0.0033	0.0183	0.0998
Echinococcus granulosus	neuropeptide Y receptor	0.0033	0.0183	0.0998
Echinococcus multilocularis	neuropeptide receptor	0.0033	0.0183	0.0183
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0053	0.0407	0.3289
Echinococcus granulosus	fmrfamide receptor	0.0033	0.0183	0.0998
Echinococcus multilocularis	geminin	0.0181	0.1834	0.1834
Brugia malayi	RE15519p	0.0033	0.0183	0.1481
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0033	0.0183	0.0998
Schistosoma mansoni	neuropeptide receptor	0.0033	0.0183	0.0998
Toxoplasma gondii	LsmAD domain-containing protein	0.0027	0.0113	0.5
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0033	0.0183	0.0998
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0033	0.0183	0.0998
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Echinococcus multilocularis	fmrfamide receptor	0.0033	0.0183	0.0183
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0033	0.0183	0.0998
Brugia malayi	Dopamine receptor protein 2	0.0033	0.0183	0.1481
Echinococcus multilocularis	fmrfamide receptor	0.0033	0.0183	0.0183
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0033	0.0183	0.0183
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0033	0.0183	0.0183
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0033	0.0183	0.0183
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0407	0.3289
Brugia malayi	putative neuropeptide receptor NPR1	0.0033	0.0183	0.1481
Trypanosoma brucei	pteridine reductase 1	0.0352	0.3735	1
Brugia malayi	MH2 domain containing protein	0.0128	0.1236	1
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0033	0.0183	0.0998
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Brugia malayi	hypothetical protein	0.0041	0.0264	0.2134
Loa Loa (eye worm)	G-protein coupled receptor	0.0033	0.0183	0.1481
Onchocerca volvulus		0.0033	0.0183	0.5
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0033	0.0183	0.0998
Schistosoma mansoni	biogenic amine receptor	0.0033	0.0183	0.0998
Brugia malayi	G protein-coupled receptor	0.0033	0.0183	0.1481
Echinococcus multilocularis	g protein coupled receptor	0.0033	0.0183	0.0183
Loa Loa (eye worm)	transcription factor SMAD2	0.0128	0.1236	1
Schistosoma mansoni	hypothetical protein	0.0181	0.1834	1
Schistosoma mansoni	amine GPCR	0.0033	0.0183	0.0998
Echinococcus granulosus	g protein coupled receptor	0.0033	0.0183	0.0998
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0033	0.0183	0.1481
Brugia malayi	G-protein coupled receptor	0.0033	0.0183	0.1481
Echinococcus granulosus	g protein coupled receptor	0.0033	0.0183	0.0998
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Brugia malayi	putative neuropeptide receptor	0.0033	0.0183	0.1481
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0033	0.0183	0.0998
Brugia malayi	hypothetical protein	0.0033	0.0183	0.1481
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0101	0.0932	0.0932
Schistosoma mansoni	hypothetical protein	0.0033	0.0183	0.0998
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Brugia malayi	Dopamine receptor	0.0033	0.0183	0.1481
Schistosoma mansoni	adenoreceptor	0.0033	0.0183	0.0998
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Echinococcus multilocularis	neuropeptide receptor	0.0033	0.0183	0.0183
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0033	0.0183	0.0998
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0033	0.0183	0.0998
Brugia malayi	G-protein coupled receptor	0.0033	0.0183	0.1481
Loa Loa (eye worm)	neuropeptide F receptor	0.0033	0.0183	0.1481
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0033	0.0183	0.0998
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0033	0.0183	0.0998
Schistosoma mansoni	opsin-like receptor	0.0033	0.0183	0.0998
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0033	0.0183	0.0183
Echinococcus granulosus	biogenic amine 5HT receptor	0.0033	0.0183	0.0998
Echinococcus granulosus	serotonin receptor	0.0033	0.0183	0.0998
Brugia malayi	AKH receptor	0.0033	0.0183	0.1481
Schistosoma mansoni	hypothetical protein	0.0181	0.1834	1
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0033	0.0183	0.0998
Brugia malayi	hypothetical protein	0.0033	0.0183	0.1481
Echinococcus granulosus	rhodopsin orphan GPCR	0.0033	0.0183	0.0998
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Echinococcus granulosus	rhodopsin orphan GPCR	0.0033	0.0183	0.0998
Loa Loa (eye worm)	melatonin receptor type 1A	0.0033	0.0183	0.1481
Brugia malayi	Serotonin receptor	0.0033	0.0183	0.1481
Schistosoma mansoni	neuropeptide receptor	0.0033	0.0183	0.0998
Brugia malayi	hypothetical protein	0.0017	0.0006	0.0048
Echinococcus granulosus	dro:myosuppressin receptor	0.0033	0.0183	0.0998
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0033	0.0183	0.0998
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0033	0.0183	0.0183
Schistosoma mansoni	transcription factor LCR-F1	0.0041	0.0264	0.1439
Onchocerca volvulus		0.0033	0.0183	0.5
Brugia malayi	hypothetical protein	0.0033	0.0183	0.1481
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0033	0.0183	0.0998
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Echinococcus granulosus	sex peptide receptor	0.0033	0.0183	0.0998
Onchocerca volvulus		0.0033	0.0183	0.5
Brugia malayi	sulfakinin receptor protein	0.0033	0.0183	0.1481
Schistosoma mansoni	amine GPCR	0.0033	0.0183	0.0998
Echinococcus granulosus	neuropeptide Y receptor	0.0033	0.0183	0.0998
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0033	0.0183	0.0183
Schistosoma mansoni	histamine h1 receptor	0.0033	0.0183	0.0998
Brugia malayi	neuropeptide F receptor	0.0033	0.0183	0.1481
Echinococcus granulosus	neuropeptides capa receptor	0.0033	0.0183	0.0998
Echinococcus granulosus	tm gpcr rhodopsin	0.0033	0.0183	0.0998
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0033	0.0183	0.0998
Echinococcus multilocularis	serotonin receptor	0.0033	0.0183	0.0183
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0033	0.0183	0.0183
Onchocerca volvulus	Dopamine\/Ecdysteroid receptor homolog	0.0033	0.0183	0.5
Echinococcus multilocularis	neuropeptides capa receptor	0.0033	0.0183	0.0183
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0101	0.0932	0.7541
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Echinococcus granulosus	neuropeptide s receptor	0.0033	0.0183	0.0998
Echinococcus multilocularis	neuropeptide Y receptor	0.0033	0.0183	0.0183
Echinococcus multilocularis	G protein coupled receptor 139	0.0033	0.0183	0.0183
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0033	0.0183	0.0998
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0033	0.0183	0.0998
Onchocerca volvulus		0.0033	0.0183	0.5
Echinococcus multilocularis	dro:myosuppressin receptor	0.0033	0.0183	0.0183
Echinococcus granulosus	rhodopsin orphan GPCR	0.0033	0.0183	0.0998
Entamoeba histolytica	hypothetical protein	0.0041	0.0264	0.5
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0033	0.0183	0.0998
Brugia malayi	neuropeptide F receptor	0.0033	0.0183	0.1481
Echinococcus granulosus	neuropeptide receptor A26	0.0033	0.0183	0.0998
Echinococcus multilocularis	g-protein coupled receptor	0.0033	0.0183	0.0183
Schistosoma mansoni	hypothetical protein	0.0041	0.0264	0.1439
Schistosoma mansoni	hypothetical protein	0.0033	0.0183	0.0998
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0033	0.0183	0.0183
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0033	0.0183	0.0998
Echinococcus granulosus	7TM GPCR rhodopsin	0.0033	0.0183	0.0998
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0033	0.0183	0.1481
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.0033	0.0183	0.1481
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Onchocerca volvulus		0.0033	0.0183	0.5
Entamoeba histolytica	hypothetical protein	0.0041	0.0264	0.5
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0101	0.0932	0.5084
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Schistosoma mansoni	neuropeptide receptor	0.0033	0.0183	0.0998
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0033	0.0183	0.1481
Loa Loa (eye worm)	G-protein coupled receptor	0.0033	0.0183	0.1481
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0101	0.0932	0.5084
Echinococcus multilocularis	orexin receptor type 2	0.0033	0.0183	0.0183
Brugia malayi	hypothetical protein	0.0033	0.0183	0.1481
Brugia malayi	Serotonin receptor	0.0033	0.0183	0.1481
Echinococcus granulosus	g-protein coupled receptor	0.0033	0.0183	0.0998
Echinococcus multilocularis	neuropeptide receptor A26	0.0033	0.0183	0.0183
Schistosoma mansoni	opsin-like receptor	0.0033	0.0183	0.0998
Plasmodium falciparum	ataxin-2 like protein, putative	0.0027	0.0113	0.5
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0033	0.0183	0.0998
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0033	0.0183	0.0183
Loa Loa (eye worm)	TYRA-2 protein	0.0033	0.0183	0.1481
Onchocerca volvulus		0.0033	0.0183	0.5
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0033	0.0183	0.0998
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0033	0.0183	0.0183
Echinococcus granulosus	g protein coupled receptor	0.0033	0.0183	0.0998
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0033	0.0183	0.0998
Onchocerca volvulus		0.0033	0.0183	0.5
Echinococcus granulosus	rhodopsin orphan GPCR	0.0033	0.0183	0.0998
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0033	0.0183	0.0183
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0033	0.0183	0.1481
Plasmodium vivax	ataxin-2 like protein, putative	0.0027	0.0113	0.5
Plasmodium falciparum	ataxin-2 like protein, putative	0.0027	0.0113	0.5
Entamoeba histolytica	hypothetical protein	0.0041	0.0264	0.5
Schistosoma mansoni	opsin-like receptor	0.0033	0.0183	0.0998
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Echinococcus granulosus	somatostatin receptor	0.0033	0.0183	0.0998
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0033	0.0183	0.0998
Loa Loa (eye worm)	neuropeptide F receptor	0.0033	0.0183	0.1481
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Onchocerca volvulus		0.0033	0.0183	0.5
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0033	0.0183	0.0998
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0033	0.0183	0.0183
Onchocerca volvulus		0.0033	0.0183	0.5
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0033	0.0183	0.0183
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0053	0.0407	0.3289
Brugia malayi	Melatonin receptor type 1A	0.0033	0.0183	0.1481
Echinococcus multilocularis	neuropeptide s receptor	0.0033	0.0183	0.0183
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0041	0.0264	0.1439
Echinococcus granulosus	hypothetical protein	0.0033	0.0183	0.0998
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Schistosoma mansoni	biogenic amine receptor	0.0033	0.0183	0.0998
Echinococcus multilocularis	neuropeptide Y receptor	0.0033	0.0183	0.0183
Echinococcus granulosus	rhodopsin orphan GPCR	0.0033	0.0183	0.0998
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0101	0.0932	0.5084
Brugia malayi	hypothetical protein	0.0033	0.0183	0.1481
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0033	0.0183	0.0183
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Trypanosoma cruzi	PAB1-binding protein , putative	0.0027	0.0113	0.5
Echinococcus granulosus	rhodopsin orphan GPCR	0.0033	0.0183	0.0998
Brugia malayi	latrophilin 2 splice variant baaae	0.0036	0.0218	0.1767
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0041	0.0264	0.0264
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0033	0.0183	0.0183
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0033	0.0183	0.0183
Echinococcus multilocularis	g protein coupled receptor	0.0033	0.0183	0.0183
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0033	0.0183	0.0183
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0033	0.0183	0.0998
Echinococcus granulosus	geminin	0.0181	0.1834	1
Brugia malayi	larval opioid receptor	0.0033	0.0183	0.1481
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0033	0.0183	0.1481
Entamoeba histolytica	hypothetical protein	0.0041	0.0264	0.5
Schistosoma mansoni	amine GPCR	0.0033	0.0183	0.0998
Schistosoma mansoni	amine GPCR	0.0033	0.0183	0.0998
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0218	0.1767
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0033	0.0183	0.0183
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Echinococcus multilocularis	g protein coupled receptor	0.0033	0.0183	0.0183
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.0033	0.0183	0.1481
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Echinococcus granulosus	tm gpcr rhodopsin	0.0033	0.0183	0.0998
Schistosoma mansoni	neuropeptide F-like receptor	0.0033	0.0183	0.0998
Echinococcus multilocularis	serotonin receptor	0.0033	0.0183	0.0183
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0033	0.0183	0.0183
Echinococcus multilocularis	neuropeptides capa receptor	0.0033	0.0183	0.0183
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Echinococcus granulosus	rhodopsin orphan GPCR	0.0033	0.0183	0.0998
Echinococcus granulosus	orexin receptor type 2	0.0033	0.0183	0.0998
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0033	0.0183	0.0183
Echinococcus multilocularis	somatostatin receptor	0.0033	0.0183	0.0183
Brugia malayi	hypothetical protein	0.0033	0.0183	0.1481
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0033	0.0183	0.0183
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Echinococcus multilocularis	allatostatin A receptor	0.0033	0.0183	0.0183
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Brugia malayi	follicle stimulating hormone receptor	0.0033	0.0183	0.1481
Schistosoma mansoni	hypothetical protein	0.0033	0.0183	0.0998
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Schistosoma mansoni	biogenic amine receptor	0.0033	0.0183	0.0998
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0033	0.0183	0.0998
Echinococcus multilocularis	sex peptide receptor	0.0033	0.0183	0.0183
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0033	0.0183	0.0998
Echinococcus granulosus	biogenic amine 5HT receptor	0.0033	0.0183	0.0998
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0101	0.0932	0.5084
Onchocerca volvulus		0.0033	0.0183	0.5
Leishmania major	pteridine reductase 1	0.0352	0.3735	1
Brugia malayi	Dopamine receptor protein 1	0.0033	0.0183	0.1481
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0033	0.0183	0.0998
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0033	0.0183	0.1481
Schistosoma mansoni	amine GPCR	0.0033	0.0183	0.0998
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0033	0.0183	0.0183
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Echinococcus granulosus	neuropeptide receptor	0.0033	0.0183	0.0998
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Trypanosoma cruzi	PAB1-binding protein , putative	0.0027	0.0113	0.5
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0033	0.0183	0.0998
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0033	0.0183	0.1481
Schistosoma mansoni	myosin xvIII	0.0033	0.0183	0.0998
Brugia malayi	ORL1-like opioid receptor	0.0033	0.0183	0.1481
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0033	0.0183	0.0998
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0183	0.1481
Onchocerca volvulus		0.0033	0.0183	0.5
Echinococcus granulosus	tm gpcr rhodopsin	0.0033	0.0183	0.0998
Echinococcus granulosus	G protein coupled receptor 139	0.0033	0.0183	0.0998
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0033	0.0183	0.1481
Brugia malayi	hypothetical protein	0.0033	0.0183	0.1481
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0101	0.0932	0.0932
Brugia malayi	hypothetical protein	0.0033	0.0183	0.1481
Onchocerca volvulus		0.0033	0.0183	0.5
Onchocerca volvulus		0.0033	0.0183	0.5
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0101	0.0932	0.7541
Echinococcus granulosus	neuropeptide receptor	0.0033	0.0183	0.0998

Activities

Activity type	Activity value	Assay description	Source	Reference
EC50 (functional)	= 10 uM	Antitrypanosomal activity against Trypanosoma brucei by cell culture assay	ChEMBL.	19527033
EC50 (functional)	= 10 uM	Antitrypanosomal activity against bloodstream forms of Trypanosoma brucei assessed as growth inhibition	ChEMBL.	25072876
Inhibition (binding)		Inhibition of human DHFR-mediated reduction of cytochrome c at upto 30 uM	ChEMBL.	19527033
Ki (binding)	= 0.007 uM	Apparent inhibition of Trypanosoma brucei pteridine reductase 1-mediated reduction of cytochrome c	ChEMBL.	19527033

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Trypanosoma brucei gambiense		19527033
Trypanosoma brucei	ChEMBL23	19527033

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: CHEMBL484995

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 985986