TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 496.517 | Formula: C27H24N6O4
H donors: 0 H acceptors: 2 LogP: 5.22 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: COC(=O)C1=NN([C@@H]2N1c1ccccc1N1[C@@]2(C)N(N=C1C(=O)OC)c1ccccc1)c1ccccc1
InChi: 1S/C27H24N6O4/c1-27-26-30(22(24(34)36-2)28-32(26)18-12-6-4-7-13-18)20-16-10-11-17-21(20)31(27)23(25(35)37-3)29-33(27)19-14-8-5-9-15-19/h4-17,26H,1-3H3/t26-,27-/m0/s1
InChiKey: DGXGHCUMZXLBKO-SVBPBHIXSA-N

Network

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Target Layer

Model Organisms

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

TDR Pathogens:

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

Other Pathogens:

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

Compound Layer

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Clustering layers

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus granulosus	tachykinin peptides receptor 99D	0.104907	0.245537	0.245537
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.104907	0.245537	0.697365
Onchocerca volvulus		0.104907	0.245537	0.690018
Brugia malayi	hypothetical protein	0.104907	0.245537	0.352913
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Echinococcus granulosus	rhodopsin orphan GPCR	0.104907	0.245537	0.245537
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.104907	0.245537	0.352913
Echinococcus multilocularis	GPCR, family 2	0.0219058	0.0421199	0.0421199
Echinococcus granulosus	rhodopsin orphan GPCR	0.104907	0.245537	0.245537
Trichomonas vaginalis	tubulin epsilon chain, putative	0.132241	0.312526	1
Schistosoma mansoni	neuropeptide receptor	0.104907	0.245537	0.697365
Echinococcus granulosus	neuropeptide FF receptor 2	0.104907	0.245537	0.245537
Echinococcus multilocularis	neuropeptide receptor A26	0.104907	0.245537	0.245537
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.104907	0.245537	0.697365
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Echinococcus multilocularis	neuropeptides capa receptor	0.104907	0.245537	0.245537
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Schistosoma mansoni	neuropeptide receptor	0.136192	0.322209	0.915125
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Loa Loa (eye worm)	neuropeptide F receptor	0.104907	0.245537	0.62833
Loa Loa (eye worm)	BEN-1 protein	0.132241	0.312526	0.799754
Brugia malayi	G protein-coupled receptor	0.104907	0.245537	0.352913
Echinococcus granulosus	rhodopsin orphan GPCR	0.104907	0.245537	0.245537
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Onchocerca volvulus		0.104907	0.245537	0.690018
Brugia malayi	putative neuropeptide receptor	0.104907	0.245537	0.352913
Brugia malayi	Tubulin beta-1 chain	0.132241	0.312526	0.449738
Schistosoma mansoni	biogenic amine receptor	0.104907	0.245537	0.697365
Leishmania major	beta tubulin	0.132241	0.312526	1
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.104907	0.245537	0.245537
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Toxoplasma gondii	beta-tubulin, putative	0.132241	0.312526	1
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.104907	0.245537	0.62833
Echinococcus multilocularis	rhodopsin orphan GPCR	0.104907	0.245537	0.245537
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.104907	0.245537	0.352913
Echinococcus multilocularis	tubulin beta 1 chain	0.132241	0.312526	0.312526
Echinococcus granulosus	tm gpcr rhodopsin	0.104907	0.245537	0.245537
Brugia malayi	AKH receptor	0.104907	0.245537	0.352913
Brugia malayi	hypothetical protein	0.104907	0.245537	0.352913
Leishmania major	beta tubulin	0.132241	0.312526	1
Entamoeba histolytica	tubulin family protein	0.132241	0.312526	0.5
Schistosoma mansoni	neuropeptide receptor	0.104907	0.245537	0.697365
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.104907	0.245537	0.245537
Brugia malayi	GnHR receptor homolog	0.28758	0.693224	1
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Echinococcus multilocularis	serotonin receptor	0.104907	0.245537	0.245537
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.104907	0.245537	0.245537
Brugia malayi	hypothetical protein	0.104907	0.245537	0.352913
Schistosoma mansoni	myosin xvIII	0.104907	0.245537	0.697365
Loa Loa (eye worm)	hypothetical protein	0.00557101	0.00208719	0.00534111
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Loa Loa (eye worm)	tubulin beta chain	0.132241	0.312526	0.799754
Echinococcus granulosus	ephrin type A receptor 4 A	0.0136761	0.021951	0.021951
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.104907	0.245537	0.245537
Leishmania major	beta tubulin	0.132241	0.312526	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.104907	0.245537	0.697365
Schistosoma mansoni	biogenic amine receptor	0.104907	0.245537	0.697365
Echinococcus granulosus	biogenic amine 5HT receptor	0.104907	0.245537	0.245537
Echinococcus granulosus	g protein coupled receptor	0.104907	0.245537	0.245537
Trypanosoma cruzi	beta tubulin, putative	0.132241	0.312526	1
Leishmania major	beta tubulin	0.132241	0.312526	1
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.104907	0.245537	0.245537
Trichomonas vaginalis	tubulin gamma chain, putative	0.132241	0.312526	1
Echinococcus granulosus	hypothetical protein	0.104907	0.245537	0.245537
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.104907	0.245537	0.697365
Echinococcus multilocularis	Tubulin beta 2C chain	0.132241	0.312526	0.312526
Echinococcus granulosus	neuropeptide receptor	0.136192	0.322209	0.322209
Onchocerca volvulus		0.104907	0.245537	0.690018
Leishmania major	beta tubulin	0.132241	0.312526	1
Brugia malayi	Serotonin receptor	0.104907	0.245537	0.352913
Echinococcus granulosus	tubulin beta 1 chain	0.132241	0.312526	0.312526
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Echinococcus granulosus	rhodopsin orphan GPCR	0.104907	0.245537	0.245537
Echinococcus granulosus	neuropeptide s receptor	0.104907	0.245537	0.245537
Echinococcus granulosus	Tubulin beta 2C chain	0.132241	0.312526	0.312526
Echinococcus multilocularis	g-protein coupled receptor	0.104907	0.245537	0.245537
Brugia malayi	neuropeptide F receptor	0.104907	0.245537	0.352913
Schistosoma mansoni	hypothetical protein	0.0219058	0.0421199	0.119627
Schistosoma mansoni	hypothetical protein	0.104907	0.245537	0.697365
Leishmania major	beta tubulin	0.132241	0.312526	1
Onchocerca volvulus		0.148386	0.352093	1
Schistosoma mansoni	tubulin subunit beta	0.132241	0.312526	0.887623
Brugia malayi	sulfakinin receptor protein	0.164171	0.390777	0.562843
Schistosoma mansoni	adenoreceptor	0.104907	0.245537	0.697365
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.104907	0.245537	0.245537
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0219058	0.0421199	0.0421199
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.104907	0.245537	0.697365
Echinococcus multilocularis	somatostatin receptor	0.104907	0.245537	0.245537
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0692331	0.158108	0.226543
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.104907	0.245537	0.697365
Loa Loa (eye worm)	hypothetical protein	0.148386	0.352093	0.901006
Echinococcus granulosus	g protein coupled receptor	0.104907	0.245537	0.245537
Trichomonas vaginalis	tubulin alpha chain, putative	0.132241	0.312526	1
Echinococcus granulosus	neuropeptide Y receptor	0.104907	0.245537	0.245537
Echinococcus multilocularis	neuropeptide receptor	0.104907	0.245537	0.245537
Echinococcus granulosus	serotonin receptor	0.104907	0.245537	0.245537
Schistosoma mansoni	hypothetical protein	0.104907	0.245537	0.697365
Loa Loa (eye worm)	beta-tubulin	0.132241	0.312526	0.799754
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Loa Loa (eye worm)	hypothetical protein	0.164171	0.390777	1
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0692331	0.158108	0.404599
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.104907	0.245537	0.245537
Onchocerca volvulus	Neuropeptide F receptor homolog	0.104907	0.245537	0.690018
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.104907	0.245537	0.62833
Echinococcus granulosus	GPCR family 2	0.0219058	0.0421199	0.0421199
Onchocerca volvulus		0.104907	0.245537	0.690018
Plasmodium falciparum	tubulin beta chain	0.132241	0.312526	1
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Echinococcus granulosus	tm gpcr rhodopsin	0.412755	1	1
Giardia lamblia	Beta tubulin	0.132241	0.312526	0.5
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Schistosoma mansoni	growth hormone secretagogue receptor	0.104907	0.245537	0.697365
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Brugia malayi	Dopamine receptor	0.104907	0.245537	0.352913
Trypanosoma brucei	beta tubulin	0.132241	0.312526	1
Onchocerca volvulus		0.104907	0.245537	0.690018
Echinococcus multilocularis	g protein coupled receptor	0.104907	0.245537	0.245537
Echinococcus multilocularis	dro:myosuppressin receptor	0.104907	0.245537	0.245537
Echinococcus multilocularis	ephrin type A receptor 4 A	0.0136761	0.021951	0.021951
Onchocerca volvulus	Dopamine\/Ecdysteroid receptor homolog	0.104907	0.245537	0.690018
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.104907	0.245537	0.352913
Echinococcus granulosus	dro:myosuppressin receptor	0.104907	0.245537	0.245537
Echinococcus granulosus	orexin receptor type 2	0.104907	0.245537	0.245537
Loa Loa (eye worm)	hypothetical protein	0.0109472	0.0152629	0.0390577
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0219058	0.0421199	0.0588936
Loa Loa (eye worm)	hypothetical protein	0.00812465	0.00834556	0.0213563
Brugia malayi	hypothetical protein	0.104907	0.245537	0.352913
Echinococcus multilocularis	rhodopsin orphan GPCR	0.104907	0.245537	0.245537
Schistosoma mansoni	hypothetical protein	0.0473273	0.104422	0.296575
Schistosoma mansoni	tubulin subunit beta	0.132241	0.312526	0.887623
Schistosoma mansoni	hypothetical protein	0.104907	0.245537	0.697365
Schistosoma mansoni	opsin-like receptor	0.104907	0.245537	0.697365
Brugia malayi	Latrophilin receptor protein 2	0.0219058	0.0421199	0.0588936
Echinococcus multilocularis	g protein coupled receptor	0.104907	0.245537	0.245537
Brugia malayi	G protein-coupled receptor F59B2.13	0.104907	0.245537	0.352913
Echinococcus granulosus	rhodopsin orphan GPCR	0.104907	0.245537	0.245537
Schistosoma mansoni	hypothetical protein	0.0219058	0.0421199	0.119627
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Loa Loa (eye worm)	neuropeptide F receptor	0.104907	0.245537	0.62833
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Echinococcus multilocularis	Tubulin beta 2C chain	0.132241	0.312526	0.312526
Echinococcus granulosus	biogenic amine 5HT receptor	0.104907	0.245537	0.245537
Brugia malayi	G-protein coupled receptor	0.104907	0.245537	0.352913
Schistosoma mansoni	tubulin subunit beta	0.132241	0.312526	0.887623
Echinococcus multilocularis	G-protein coupled receptor, putative	0.104907	0.245537	0.245537
Echinococcus multilocularis	neuropeptide receptor	0.136192	0.322209	0.322209
Brugia malayi	hypothetical protein	0.104907	0.245537	0.352913
Onchocerca volvulus		0.104907	0.245537	0.690018
Onchocerca volvulus		0.0109472	0.0152629	0.0201233
Onchocerca volvulus		0.104907	0.245537	0.690018
Schistosoma mansoni	biogenic amine (5HT) receptor	0.104907	0.245537	0.697365
Echinococcus granulosus	tm gpcr rhodopsin	0.104907	0.245537	0.245537
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.104907	0.245537	0.697365
Echinococcus granulosus	tubulin subunit beta	0.132241	0.312526	0.312526
Schistosoma mansoni	hypothetical protein	0.0219058	0.0421199	0.119627
Echinococcus multilocularis	allatostatin A receptor	0.148386	0.352093	0.352093
Onchocerca volvulus		0.104907	0.245537	0.690018
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.104907	0.245537	0.697365
Onchocerca volvulus		0.104907	0.245537	0.690018
Schistosoma mansoni	amine GPCR	0.104907	0.245537	0.697365
Echinococcus granulosus	Tubulin beta 2C chain	0.132241	0.312526	0.312526
Plasmodium vivax	tubulin beta chain, putative	0.132241	0.312526	1
Echinococcus multilocularis	sex peptide receptor	0.104907	0.245537	0.245537
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.104907	0.245537	0.62833
Schistosoma mansoni	alpha-1 adrenergic receptor	0.104907	0.245537	0.697365
Trypanosoma brucei	beta tubulin	0.132241	0.312526	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.104907	0.245537	0.245537
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Echinococcus granulosus	somatostatin receptor	0.104907	0.245537	0.245537
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.104907	0.245537	0.697365
Echinococcus granulosus	beta tubulin	0.132241	0.312526	0.312526
Trypanosoma brucei	beta tubulin	0.132241	0.312526	1
Schistosoma mansoni	neuropeptide F-like receptor	0.104907	0.245537	0.697365
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.104907	0.245537	0.245537
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.104907	0.245537	0.697365
Schistosoma mansoni	biogenic amine (5HT) receptor	0.104907	0.245537	0.697365
Echinococcus granulosus	beta tubulin	0.132241	0.312526	0.312526
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0219058	0.0421199	0.107785
Schistosoma mansoni	tubulin subunit beta	0.132241	0.312526	0.887623
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0219058	0.0421199	0.0421199
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0219058	0.0421199	0.0421199
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.104907	0.245537	0.352913
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.104907	0.245537	0.697365
Giardia lamblia	Beta tubulin	0.132241	0.312526	0.5
Schistosoma mansoni	hypothetical protein	0.104907	0.245537	0.697365
Schistosoma mansoni	biogenic amine receptor	0.104907	0.245537	0.697365
Loa Loa (eye worm)	hypothetical protein	0.0219058	0.0421199	0.107785
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Echinococcus granulosus	g protein coupled receptor	0.104907	0.245537	0.245537
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.104907	0.245537	0.697365
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.104907	0.245537	0.697365
Entamoeba histolytica	tubulin family protein	0.132241	0.312526	0.5
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Schistosoma mansoni	neuropeptide f receptor 76f	0.104907	0.245537	0.697365
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Brugia malayi	Dopamine receptor protein 1	0.104907	0.245537	0.352913
Brugia malayi	Tachykinin-like peptides receptor 99D	0.104907	0.245537	0.352913
Leishmania major	beta tubulin	0.132241	0.312526	1
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Schistosoma mansoni	prolyl oligopeptidase (S09 family)	0.00812465	0.00834556	0.0237027
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Brugia malayi	Melatonin receptor type 1A	0.104907	0.245537	0.352913
Echinococcus multilocularis	orexin receptor type 2	0.104907	0.245537	0.245537
Brugia malayi	hypothetical protein	0.104907	0.245537	0.352913
Echinococcus granulosus	Tubulin beta 2C chain	0.132241	0.312526	0.312526
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.412755	1	1
Echinococcus granulosus	sex peptide receptor	0.104907	0.245537	0.245537
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.104907	0.245537	0.697365
Onchocerca volvulus		0.104907	0.245537	0.690018
Brugia malayi	G-protein coupled receptor	0.104907	0.245537	0.352913
Echinococcus granulosus	Tubulin beta 2C chain	0.132241	0.312526	0.312526
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Schistosoma mansoni	amine GPCR	0.104907	0.245537	0.697365
Schistosoma mansoni	amine GPCR	0.104907	0.245537	0.697365
Brugia malayi	neuropeptide F receptor	0.104907	0.245537	0.352913
Loa Loa (eye worm)	tubulin beta-1 chain	0.132241	0.312526	0.799754
Echinococcus granulosus	Tubulin beta 2C chain	0.132241	0.312526	0.312526
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Schistosoma mansoni	neuropeptide receptor	0.104907	0.245537	0.697365
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.104907	0.245537	0.245537
Echinococcus granulosus	tubulin beta 4A class IVa	0.132241	0.312526	0.312526
Trichomonas vaginalis	tubulin, putative	0.132241	0.312526	1
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Echinococcus multilocularis	rhodopsin orphan GPCR	0.104907	0.245537	0.245537
Echinococcus granulosus	g-protein coupled receptor	0.104907	0.245537	0.245537
Schistosoma mansoni	histamine h1 receptor	0.104907	0.245537	0.697365
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Echinococcus multilocularis	neuropeptide Y receptor	0.104907	0.245537	0.245537
Echinococcus multilocularis	fmrfamide receptor	0.104907	0.245537	0.245537
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.104907	0.245537	0.245537
Toxoplasma gondii	beta tubulin	0.132241	0.312526	1
Onchocerca volvulus		0.104907	0.245537	0.690018
Schistosoma mansoni	hypothetical protein	0.0219058	0.0421199	0.119627
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Leishmania major	beta tubulin	0.132241	0.312526	1
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.104907	0.245537	0.352913
Schistosoma mansoni	tubulin subunit beta	0.132241	0.312526	0.887623
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Echinococcus multilocularis	rhodopsin orphan GPCR	0.104907	0.245537	0.245537
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.148386	0.352093	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.104907	0.245537	0.697365
Echinococcus multilocularis	rhodopsin orphan GPCR	0.104907	0.245537	0.245537
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0219058	0.0421199	0.0421199
Echinococcus granulosus	7TM GPCR rhodopsin	0.104907	0.245537	0.245537
Echinococcus multilocularis	prolyl endopeptidase	0.00812465	0.00834556	0.00834556
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Loa Loa (eye worm)	tubulin beta-2A chain	0.132241	0.312526	0.799754
Loa Loa (eye worm)	tubulin beta-4 chain	0.132241	0.312526	0.799754
Echinococcus multilocularis	rhodopsin orphan GPCR	0.104907	0.245537	0.245537
Echinococcus multilocularis	tubulin, beta 4A class IVa	0.132241	0.312526	0.312526
Toxoplasma gondii	prolyl endopeptidase	0.00812465	0.00834556	0.0267036
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.104907	0.245537	0.697365
Leishmania major	beta tubulin	0.132241	0.312526	1
Loa Loa (eye worm)	melatonin receptor type 1A	0.104907	0.245537	0.62833
Onchocerca volvulus		0.104907	0.245537	0.690018
Onchocerca volvulus		0.104907	0.245537	0.690018
Echinococcus granulosus	neuropeptide receptor A26	0.104907	0.245537	0.245537
Echinococcus multilocularis	Tubulin beta 2C chain	0.132241	0.312526	0.312526
Schistosoma mansoni	amine GPCR	0.104907	0.245537	0.697365
Brugia malayi	putative neuropeptide receptor NPR1	0.104907	0.245537	0.352913
Brugia malayi	hypothetical protein	0.164171	0.390777	0.562843
Schistosoma mansoni	opsin-like receptor	0.104907	0.245537	0.697365
Echinococcus multilocularis	beta tubulin	0.132241	0.312526	0.312526
Echinococcus granulosus	neuropeptide receptor	0.104907	0.245537	0.245537
Brugia malayi	hypothetical protein	0.104907	0.245537	0.352913
Echinococcus multilocularis	neuropeptides capa receptor	0.104907	0.245537	0.245537
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.104907	0.245537	0.245537
Echinococcus multilocularis	Tubulin beta 2C chain	0.132241	0.312526	0.312526
Echinococcus granulosus	prolyl endopeptidase	0.00812465	0.00834556	0.00834556
Toxoplasma gondii	beta-1 tubulin, putative	0.132241	0.312526	1
Echinococcus granulosus	neuropeptide Y receptor	0.104907	0.245537	0.245537
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.104907	0.245537	0.697365
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Echinococcus multilocularis	rhodopsin orphan GPCR	0.104907	0.245537	0.245537
Echinococcus multilocularis	neuropeptide FF receptor 2	0.104907	0.245537	0.245537
Echinococcus granulosus	neuropeptides capa receptor	0.104907	0.245537	0.245537
Mycobacterium tuberculosis	Probable protease II PtrBa [first part] (oligopeptidase B)	0.00693881	0.00543936	0.5
Loa Loa (eye worm)	TYRA-2 protein	0.104907	0.245537	0.62833
Leishmania major	beta tubulin	0.132241	0.312526	1
Onchocerca volvulus		0.104907	0.245537	0.690018
Brugia malayi	latrophilin 2 splice variant baaae	0.0473273	0.104422	0.148945
Brugia malayi	RE15519p	0.104907	0.245537	0.352913
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Trichomonas vaginalis	tubulin beta chain, putative	0.132241	0.312526	1
Schistosoma mansoni	opsin-like receptor	0.104907	0.245537	0.697365
Brugia malayi	larval opioid receptor	0.104907	0.245537	0.352913
Loa Loa (eye worm)	hypothetical protein	0.0473273	0.104422	0.267216
Brugia malayi	prolyl oligopeptidase family protein	0.00812465	0.00834556	0.0100762
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.104907	0.245537	0.697365
Echinococcus granulosus	alpha 1A adrenergic receptor	0.104907	0.245537	0.245537
Echinococcus multilocularis	fmrfamide receptor	0.104907	0.245537	0.245537
Brugia malayi	beta-tubulin, identical	0.132241	0.312526	0.449738
Schistosoma mansoni	cathepsin D (A01 family)	0.0139148	0.0225358	0.0640052
Echinococcus granulosus	peptide allatostatin:somatostatin	0.104907	0.245537	0.245537
Echinococcus granulosus	fmrfamide receptor	0.104907	0.245537	0.245537
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.104907	0.245537	0.245537
Echinococcus multilocularis	beta tubulin	0.132241	0.312526	0.312526
Leishmania major	beta tubulin	0.132241	0.312526	1
Echinococcus multilocularis	g protein coupled receptor	0.104907	0.245537	0.245537
Brugia malayi	ORL1-like opioid receptor	0.104907	0.245537	0.352913
Echinococcus granulosus	G protein coupled receptor 139	0.104907	0.245537	0.245537
Echinococcus granulosus	neuropeptides capa receptor	0.104907	0.245537	0.245537
Leishmania major	beta tubulin	0.132241	0.312526	1
Leishmania major	beta tubulin	0.132241	0.312526	1
Trichomonas vaginalis	tubulin epsilon chain, putative	0.132241	0.312526	1
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Leishmania major	beta tubulin	0.132241	0.312526	1
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.104907	0.245537	0.245537
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Brugia malayi	hypothetical protein	0.104907	0.245537	0.352913
Loa Loa (eye worm)	hypothetical protein	0.0692331	0.158108	0.404599
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.104907	0.245537	0.697365
Leishmania major	beta tubulin	0.132241	0.312526	1
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.104907	0.245537	0.245537
Giardia lamblia	Beta tubulin	0.132241	0.312526	0.5
Echinococcus granulosus	rhodopsin orphan GPCR	0.104907	0.245537	0.245537
Loa Loa (eye worm)	TK/EPH protein kinase	0.0140696	0.0229152	0.0586399
Brugia malayi	hypothetical protein	0.104907	0.245537	0.352913
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Brugia malayi	Dopamine receptor protein 2	0.104907	0.245537	0.352913
Brugia malayi	Serotonin receptor	0.104907	0.245537	0.352913
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.104907	0.245537	0.697365
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.104907	0.245537	0.245537
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.104907	0.245537	0.245537
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Leishmania major	beta tubulin	0.132241	0.312526	1
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.104907	0.245537	0.245537
Echinococcus granulosus	7tm_1 domain containing protein	0.104907	0.245537	0.245537
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.104907	0.245537	0.62833
Leishmania major	beta tubulin	0.132241	0.312526	1
Echinococcus granulosus	allatostatin A receptor	0.148386	0.352093	0.352093
Trypanosoma brucei	beta tubulin	0.132241	0.312526	1
Echinococcus multilocularis	Tubulin beta 2C chain	0.132241	0.312526	0.312526
Echinococcus multilocularis	G protein coupled receptor 139	0.136192	0.322209	0.322209
Loa Loa (eye worm)	hypothetical protein	0.104907	0.245537	0.62833
Loa Loa (eye worm)	G-protein coupled receptor	0.104907	0.245537	0.62833
Onchocerca volvulus		0.104907	0.245537	0.690018
Echinococcus multilocularis	neuropeptide s receptor	0.104907	0.245537	0.245537
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.104907	0.245537	0.62833
Echinococcus multilocularis	rhodopsin orphan GPCR	0.104907	0.245537	0.245537
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.104907	0.245537	0.697365
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.104907	0.245537	0.245537
Echinococcus multilocularis	neuropeptide Y receptor	0.104907	0.245537	0.245537
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.104907	0.245537	0.245537
Schistosoma mansoni	cathepsin D (A01 family)	0.0139148	0.0225358	0.0640052
Leishmania major	beta tubulin	0.132241	0.312526	1
Schistosoma mansoni	prolyl oligopeptidase (S09 family)	0.00812465	0.00834556	0.0237027
Loa Loa (eye worm)	BEN-1 protein	0.132241	0.312526	0.799754
Loa Loa (eye worm)	G-protein coupled receptor	0.104907	0.245537	0.62833
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0692331	0.158108	0.226543
Schistosoma mansoni	ephrin receptor	0.0110683	0.0155598	0.0441922
Echinococcus multilocularis	tubulin subunit beta	0.132241	0.312526	0.312526
Echinococcus multilocularis	serotonin receptor	0.104907	0.245537	0.245537
Schistosoma mansoni	amine GPCR	0.104907	0.245537	0.697365
Schistosoma mansoni	tubulin subunit beta	0.132241	0.312526	0.887623
Brugia malayi	follicle stimulating hormone receptor	0.104907	0.245537	0.352913
Onchocerca volvulus		0.104907	0.245537	0.690018
Schistosoma mansoni	neuropeptide F-like receptor	0.104907	0.245537	0.697365

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 4.29 uM	Antiparasitic activity against nifurtimox-sensitive amastigotes of Trypanosoma cruzi Tulahuen expressing LacZ gene infected in human MRC5 cells using chlorophenolred b-Dgalacto-pyranoside as substrate by colorimetric method	ChEMBL.	22197138
IC50 (functional)	= 11.62 uM	Antimalarial activity against chloroquine-sensitive Plasmodium falciparum GHA infected in human erythrocytes assessed as parasite growth after 72 hrs by malstat reagent based spectrophotometric method	ChEMBL.	22197138
IC50 (ADMET)	= 64 uM	Cytotoxicity against human MRC5 cells after 4 to 7 days using alamar blue/resazurin staining by fluorescence assay	ChEMBL.	22197138
IC50 (functional)	= 64 uM	Antiparasitic activity against amastigotes of Leishmania infantum infected in mouse peritoneal macrophages after 5 days using giemsa staining by microscopic analysis	ChEMBL.	22197138
IC50 (functional)	= 64 uM	Antiparasitic activity against trypomastigote form of drug-sensitive Trypanosoma brucei assessed as inhibition of parasite growth after 4 days using alamar blue/resazurin staining by fluorimetric method	ChEMBL.	22197138

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Plasmodium falciparum	ChEMBL23	22197138
Trypanosoma cruzi	ChEMBL23	22197138

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: CHEMBL1939611

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1592966