TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 585.076 | Formula: C30H25ClN6O3S
H donors: 2 H acceptors: 4 LogP: 5.97 Rotable bonds: 8
Rule of 5 violations (Lipinski): 2
SMILES: COc1ccc(cc1)/C=C\1/SC(=NC1=O)N1CCC[C@H]1C(=O)Nc1ccc2c(c1)c(ncn2)Nc1cccc(c1)Cl
InChi: 1S/C30H25ClN6O3S/c1-40-22-10-7-18(8-11-22)14-26-29(39)36-30(41-26)37-13-3-6-25(37)28(38)35-21-9-12-24-23(16-21)27(33-17-32-24)34-20-5-2-4-19(31)15-20/h2,4-5,7-12,14-17,25H,3,6,13H2,1H3,(H,35,38)(H,32,33,34)/b26-14+/t25-/m0/s1
InChiKey: QUOXDJAMDRVEPI-MDQJKVKYSA-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	g protein coupled receptor	0.0042	0.1038	0.0803
Brugia malayi	G-protein coupled receptor	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0042	0.1038	0.1038
Brugia malayi	G protein-coupled receptor F59B2.13	0.0042	0.1038	0.0803
Schistosoma mansoni	biogenic amine receptor	0.0042	0.1038	0.1038
Brugia malayi	putative neuropeptide receptor	0.0042	0.1038	0.0803
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0042	0.1038	0.0803
Trypanosoma brucei	Voltage-dependent calcium channel subunit, putative	0.0043	0.1084	0.5
Brugia malayi	Dopamine receptor	0.0042	0.1038	0.0803
Brugia malayi	putative neuropeptide receptor NPR1	0.0042	0.1038	0.0803
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.0126	0.5349	0.5227
Echinococcus granulosus	voltage dependent calcium channel type d subunit\|voltage dependent calcium channel alpha 1	0.0065	0.2204	0.2
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Echinococcus multilocularis	sodium channel protein	0.0057	0.1787	0.1572
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0042	0.1038	0.1038
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Brugia malayi	Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog	0.0039	0.0839	0.0599
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0042	0.1038	0.0803
Brugia malayi	G-protein coupled receptor	0.0042	0.1038	0.0803
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0042	0.1038	0.1038
Echinococcus granulosus	voltage dependent calcium channel type d subunit\|voltage dependent calcium channel\|voltage dependent L type calcium channel subu	0.0065	0.2204	0.2
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0042	0.1038	0.1038
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0042	0.1038	0.0803
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0042	0.1038	0.1038
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0042	0.1038	0.0803
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0042	0.1038	0.0803
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0042	0.1038	0.0803
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0042	0.1038	0.1038
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0042	0.1038	0.1038
Echinococcus multilocularis	synaptic vesicular amine transporter	0.0215	1	1
Brugia malayi	follicle stimulating hormone receptor	0.0042	0.1038	0.0803
Schistosoma mansoni	amine GPCR	0.0042	0.1038	0.1038
Echinococcus granulosus	neuropeptide receptor	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Echinococcus granulosus	rhodopsin orphan GPCR	0.0042	0.1038	0.0803
Echinococcus granulosus	hypothetical protein	0.0042	0.1038	0.0803
Schistosoma mansoni	hyperpolarization activated cyclic nucleotide-gated potassium channel	0.0027	0.0255	0.0255
Schistosoma mansoni	amine GPCR	0.0042	0.1038	0.1038
Brugia malayi	Serotonin receptor	0.0042	0.1038	0.0803
Schistosoma mansoni	hypothetical protein	0.0042	0.1038	0.1038
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Brugia malayi	hypothetical protein	0.0042	0.1038	0.0803
Echinococcus multilocularis	voltage dependent L type calcium channel subunit	0.0065	0.2204	0.2
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0042	0.1038	0.0803
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0042	0.1038	0.0803
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0042	0.1038	0.1038
Schistosoma mansoni	voltage-gated potassium channel	0.0039	0.0839	0.0839
Echinococcus granulosus	neuropeptide Y receptor	0.0042	0.1038	0.0803
Echinococcus granulosus	rhodopsin orphan GPCR	0.0042	0.1038	0.0803
Schistosoma mansoni	amine GPCR	0.0042	0.1038	0.1038
Brugia malayi	hypothetical protein	0.0042	0.1038	0.0803
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0042	0.1038	0.0803
Echinococcus granulosus	biogenic amine 5HT receptor	0.0042	0.1038	0.0803
Brugia malayi	neuropeptide F receptor	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0839	0.0599
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0042	0.1038	0.1038
Echinococcus granulosus	allatostatin A receptor	0.0042	0.1038	0.0803
Echinococcus multilocularis	neuropeptides capa receptor	0.0042	0.1038	0.0803
Echinococcus multilocularis	g protein coupled receptor	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0042	0.1038	0.0803
Echinococcus multilocularis	serotonin transporter	0.0126	0.5346	0.5224
Echinococcus multilocularis	g protein coupled receptor	0.0042	0.1038	0.0803
Echinococcus multilocularis	voltage gated potassium channel	0.0039	0.0839	0.0599
Brugia malayi	GnHR receptor homolog	0.0042	0.1038	0.0803
Echinococcus granulosus	dro:myosuppressin receptor	0.0042	0.1038	0.0803
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0027	0.0255	0.0255
Loa Loa (eye worm)	norepinephrine transporter	0.0126	0.5346	0.5224
Treponema pallidum	sodium- and chloride- dependent transporter	0.0126	0.5346	0.5
Schistosoma mansoni	neuropeptide receptor	0.0042	0.1038	0.1038
Echinococcus multilocularis	voltage dependent calcium channel type d subunit	0.0065	0.2204	0.2
Schistosoma mansoni	neuropeptide receptor	0.0042	0.1038	0.1038
Echinococcus multilocularis	serotonin receptor	0.0042	0.1038	0.0803
Brugia malayi	sulfakinin receptor protein	0.0042	0.1038	0.0803
Schistosoma mansoni	growth hormone secretagogue receptor	0.0042	0.1038	0.1038
Schistosoma mansoni	neuropeptide f receptor 76f	0.0042	0.1038	0.1038
Echinococcus multilocularis	voltage dependent calcium channel	0.0065	0.2204	0.2
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Schistosoma mansoni	hypothetical protein	0.0042	0.1038	0.1038
Echinococcus multilocularis	g protein coupled receptor	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0126	0.5346	0.5224
Schistosoma mansoni	high voltage-activated calcium channel Cav1	0.0065	0.2204	0.2204
Echinococcus multilocularis	neuropeptide receptor	0.0042	0.1038	0.0803
Brugia malayi	hypothetical protein	0.0042	0.1038	0.0803
Echinococcus multilocularis	voltage dependent L type calcium channel subunit	0.0065	0.2204	0.2
Echinococcus granulosus	tm gpcr rhodopsin	0.0042	0.1038	0.0803
Schistosoma mansoni	neuropeptide receptor	0.0042	0.1038	0.1038
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0042	0.1038	0.0803
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0042	0.1038	0.0803
Leishmania major	calcium channel protein, putative,ion transporter, putative	0.0035	0.0646	0.5
Echinococcus granulosus	tm gpcr rhodopsin	0.0042	0.1038	0.0803
Schistosoma mansoni	histamine h1 receptor	0.0042	0.1038	0.1038
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0042	0.1038	0.0803
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0042	0.1038	0.1038
Echinococcus granulosus	g protein coupled receptor	0.0042	0.1038	0.0803
Brugia malayi	hypothetical protein	0.0042	0.1038	0.0803
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0042	0.1038	0.1038
Echinococcus multilocularis	g-protein coupled receptor	0.0042	0.1038	0.0803
Onchocerca volvulus		0.0126	0.5346	1
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.0042	0.1038	0.0803
Echinococcus granulosus	neuropeptide s receptor	0.0042	0.1038	0.0803
Schistosoma mansoni	voltage-gated potassium channel	0.0137	0.5932	0.5932
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0042	0.1038	0.1038
Schistosoma mansoni	hypothetical protein	0.0042	0.1038	0.1038
Brugia malayi	RE15519p	0.0042	0.1038	0.0803
Loa Loa (eye worm)	neuropeptide F receptor	0.0042	0.1038	0.0803
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0039	0.0839	0.0599
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0042	0.1038	0.1038
Schistosoma mansoni	voltage-gated potassium channel	0.0027	0.0255	0.0255
Echinococcus granulosus	G protein coupled receptor 139	0.0042	0.1038	0.0803
Loa Loa (eye worm)	TYRA-2 protein	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Brugia malayi	Dopamine receptor protein 2	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0042	0.1038	0.1038
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0042	0.1038	0.0803
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Echinococcus granulosus	synaptic vesicular amine transporter	0.0215	1	1
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0042	0.1038	0.1038
Loa Loa (eye worm)	solute carrier family 6 member 4	0.0126	0.5346	0.5224
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Echinococcus granulosus	rhodopsin orphan GPCR	0.0042	0.1038	0.0803
Echinococcus granulosus	serotonin transporter	0.0126	0.5346	0.5224
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0115	0.4774	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0042	0.1038	0.0803
Echinococcus granulosus	voltage gated sodium channel Nav1 alpha subunit	0.0057	0.1787	0.1572
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0042	0.1038	0.1038
Schistosoma mansoni	opsin-like receptor	0.0042	0.1038	0.1038
Echinococcus multilocularis	allatostatin A receptor	0.0042	0.1038	0.0803
Brugia malayi	G protein-coupled receptor	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0126	0.5346	0.5224
Schistosoma mansoni	voltage-gated potassium channel	0.0137	0.5932	0.5932
Echinococcus granulosus	voltage gated potassium channel	0.0039	0.0839	0.0599
Brugia malayi	hypothetical protein	0.0042	0.1038	0.0803
Schistosoma mansoni	sodium/chloride dependent transporter	0.0126	0.5346	0.5346
Echinococcus granulosus	7tm_1 domain containing protein	0.0042	0.1038	0.0803
Echinococcus granulosus	sodium channel protein	0.0035	0.0646	0.0401
Brugia malayi	Voltage-gated calcium channel, L-type, alpha subunit. C. elegans egl-19 ortholog	0.0065	0.2204	0.2
Echinococcus granulosus	rhodopsin orphan GPCR	0.0042	0.1038	0.0803
Echinococcus multilocularis	dro:myosuppressin receptor	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Echinococcus multilocularis	neuropeptide s receptor	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Loa Loa (eye worm)	calcium channel	0.0065	0.2204	0.2
Echinococcus granulosus	orexin receptor type 2	0.0042	0.1038	0.0803
Echinococcus granulosus	voltage dependent calcium channel	0.0065	0.2204	0.2
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0042	0.1038	0.0803
Loa Loa (eye worm)	neuropeptide F receptor	0.0042	0.1038	0.0803
Brugia malayi	hypothetical protein	0.0042	0.1038	0.0803
Schistosoma mansoni	high voltage-activated calcium channel Cav2A	0.0065	0.2204	0.2204
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0042	0.1038	0.0803
Brugia malayi	larval opioid receptor	0.0042	0.1038	0.0803
Loa Loa (eye worm)	abnormal catecholamine distribution protein 1	0.0215	1	1
Schistosoma mansoni	opsin-like receptor	0.0042	0.1038	0.1038
Echinococcus granulosus	voltage dependent L type calcium channel subunit\|voltage dependent calcium channel	0.0065	0.2204	0.2
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0042	0.1038	0.1038
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Loa Loa (eye worm)	melatonin receptor type 1A	0.0042	0.1038	0.0803
Echinococcus multilocularis	neuropeptide Y receptor	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Schistosoma mansoni	neuropeptide F-like receptor	0.0042	0.1038	0.1038
Echinococcus granulosus	rhodopsin orphan GPCR	0.0042	0.1038	0.0803
Echinococcus multilocularis	voltage dependent calcium channel type d subunit	0.0065	0.2204	0.2
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0042	0.1038	0.0803
Echinococcus granulosus	tm gpcr rhodopsin	0.0042	0.1038	0.0803
Echinococcus granulosus	neuropeptide FF receptor 2	0.0042	0.1038	0.0803
Echinococcus granulosus	rhodopsin orphan GPCR	0.0042	0.1038	0.0803
Echinococcus multilocularis	fmrfamide receptor	0.0042	0.1038	0.0803
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0042	0.1038	0.0803
Brugia malayi	hypothetical protein	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Echinococcus granulosus	neuropeptide receptor A26	0.0042	0.1038	0.0803
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0042	0.1038	0.0803
Echinococcus multilocularis	G protein coupled receptor 139	0.0042	0.1038	0.0803
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0042	0.1038	0.1038
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Schistosoma mansoni	neuropeptide F-like receptor	0.0042	0.1038	0.1038
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0042	0.1038	0.1038
Echinococcus granulosus	serotonin receptor	0.0042	0.1038	0.0803
Echinococcus granulosus	fmrfamide receptor	0.0042	0.1038	0.0803
Echinococcus multilocularis	neuropeptide receptor A26	0.0042	0.1038	0.0803
Loa Loa (eye worm)	serotonin transporter b	0.0126	0.5346	0.5224
Schistosoma mansoni	vesicular amine transporter	0.0215	1	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0042	0.1038	0.1038
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0042	0.1038	0.0803
Brugia malayi	Dopamine receptor protein 1	0.0042	0.1038	0.0803
Echinococcus multilocularis	somatostatin receptor	0.0042	0.1038	0.0803
Schistosoma mansoni	hypothetical protein	0.0042	0.1038	0.1038
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Echinococcus granulosus	g-protein coupled receptor	0.0042	0.1038	0.0803
Schistosoma mansoni	myosin xvIII	0.0042	0.1038	0.1038
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0042	0.1038	0.0803
Echinococcus granulosus	7TM GPCR rhodopsin	0.0042	0.1038	0.0803
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0039	0.0839	0.0599
Echinococcus granulosus	g protein coupled receptor	0.0042	0.1038	0.0803
Trypanosoma cruzi	Voltage-dependent calcium channel subunit, putative	0.0043	0.1084	0.5
Brugia malayi	ORL1-like opioid receptor	0.0042	0.1038	0.0803
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0042	0.1038	0.0803
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0042	0.1038	0.0803
Schistosoma mansoni	norepinephrine/norepinephrine transporter	0.0126	0.5346	0.5346
Brugia malayi	hypothetical protein	0.0042	0.1038	0.0803
Brugia malayi	hypothetical protein	0.0042	0.1038	0.0803
Brugia malayi	AKH receptor	0.0042	0.1038	0.0803
Echinococcus multilocularis	neuropeptides capa receptor	0.0042	0.1038	0.0803
Echinococcus multilocularis	neuropeptide Y receptor	0.0042	0.1038	0.0803
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0126	0.5349	0.5227
Echinococcus granulosus	neuropeptide Y receptor	0.0042	0.1038	0.0803
Echinococcus multilocularis	serotonin receptor	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Echinococcus granulosus	neuropeptides capa receptor	0.0042	0.1038	0.0803
Echinococcus multilocularis	voltage dependent calcium channel	0.0065	0.2204	0.2
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0042	0.1038	0.1038
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0042	0.1038	0.0803
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0042	0.1038	0.1038
Loa Loa (eye worm)	hypothetical protein	0.0109	0.451	0.4367
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0042	0.1038	0.0803
Brugia malayi	neuropeptide F receptor	0.0042	0.1038	0.0803
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0042	0.1038	0.1038
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0042	0.1038	0.0803
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0115	0.4774	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0042	0.1038	0.0803
Schistosoma mansoni	biogenic amine receptor	0.0042	0.1038	0.1038
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0042	0.1038	0.1038
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0042	0.1038	0.0803
Schistosoma mansoni	amine GPCR	0.0042	0.1038	0.1038
Brugia malayi	Sodium:neurotransmitter symporter family protein	0.0126	0.5346	0.5224
Echinococcus multilocularis	neuropeptide receptor	0.0042	0.1038	0.0803
Schistosoma mansoni	voltage-gated cation channel	0.0065	0.2204	0.2204
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0042	0.1038	0.0803
Schistosoma mansoni	neuropeptide receptor	0.0042	0.1038	0.1038
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0042	0.1038	0.0803
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.0126	0.5349	0.5227
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Brugia malayi	hypothetical protein	0.0042	0.1038	0.0803
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0027	0.0255	0.0255
Schistosoma mansoni	voltage-gated potassium channel	0.0039	0.0839	0.0839
Schistosoma mansoni	adenoreceptor	0.0042	0.1038	0.1038
Brugia malayi	Serotonin receptor	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Loa Loa (eye worm)	G-protein coupled receptor	0.0042	0.1038	0.0803
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0042	0.1038	0.0803
Schistosoma mansoni	amine GPCR	0.0042	0.1038	0.1038
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0042	0.1038	0.0803
Echinococcus granulosus	somatostatin receptor	0.0042	0.1038	0.0803
Loa Loa (eye worm)	G-protein coupled receptor	0.0042	0.1038	0.0803
Echinococcus granulosus	sex peptide receptor	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0042	0.1038	0.0803
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0027	0.0255	0.0255
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Echinococcus granulosus	rhodopsin orphan GPCR	0.0042	0.1038	0.0803
Echinococcus multilocularis	orexin receptor type 2	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Echinococcus granulosus	biogenic amine 5HT receptor	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0126	0.5346	0.5224
Schistosoma mansoni	opsin-like receptor	0.0042	0.1038	0.1038
Schistosoma mansoni	hyperpolarization activated cyclic nucleotide-gated potassium channel	0.0027	0.0255	0.0255
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0042	0.1038	0.1038
Echinococcus granulosus	neuropeptide receptor	0.0042	0.1038	0.0803
Echinococcus multilocularis	sex peptide receptor	0.0042	0.1038	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1038	0.0803
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0042	0.1038	0.0803
Brugia malayi	Melatonin receptor type 1A	0.0042	0.1038	0.0803
Echinococcus multilocularis	fmrfamide receptor	0.0042	0.1038	0.0803
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0126	0.5349	0.5227
Loa Loa (eye worm)	hypothetical protein	0.0065	0.2204	0.2
Echinococcus granulosus	neuropeptides capa receptor	0.0042	0.1038	0.0803
Schistosoma mansoni	biogenic amine receptor	0.0042	0.1038	0.1038
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0042	0.1038	0.0803
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0042	0.1038	0.0803

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 19 uM	Antiproliferative activity against human HepG2 cells assessed as cell growth by MTT assay	ChEMBL.	26003342
IC50 (functional)	= 31.7 uM	Antiproliferative activity against human A549 cells assessed as cell growth by MTT assay	ChEMBL.	26003342

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	ChEMBL23	26003342

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: CHEMBL3586188

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1935427