TDR Targets

Basic information

Technical information

TDR Targets ID: 414034
Name: 6-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-[( E)-3-methoxypropoxyiminomethyl]pyrimidin-4-am ine
MW: 373.382 | Formula: C18H20FN5O3
H donors: 2 H acceptors: 2 LogP: 2.6 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: COCCCO/N=C/c1c(N)ncnc1Oc1ccc2c(c1F)cc([nH]2)C
InChi: 1S/C18H20FN5O3/c1-11-8-12-14(24-11)4-5-15(16(12)19)27-18-13(17(20)21-10-22-18)9-23-26-7-3-6-25-2/h4-5,8-10,24H,3,6-7H2,1-2H3,(H2,20,21,22)/b23-9+
InChiKey: YSMSWYULVKNYGX-NUGSKGIGSA-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

6-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-[(E)-3-methoxypropoxyiminomethyl]-4-pyrimidinamine
[6-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-[(E)-3-methoxypropyloximinomethyl]pyrimidin-4-yl]amine
[6-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-[(E)-3-methoxypropoxyiminomethyl]pyrimidin-4-yl]amine

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	ret proto-oncogene	Starlite/ChEMBL	References
Homo sapiens	kinase insert domain receptor	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Onchocerca volvulus	Tyrosine kinase homolog	Get druggable targets OG5_130320	All targets in OG5_130320
Onchocerca volvulus		Get druggable targets OG5_130320	All targets in OG5_130320
Brugia malayi	Immunoglobulin I-set domain containing protein	Get druggable targets OG5_130320	All targets in OG5_130320
Loa Loa (eye worm)	TK/KIN16 protein kinase	Get druggable targets OG5_130320	All targets in OG5_130320

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 multilocularis	rhodopsin orphan GPCR	0.0084	0.0682	0.4628
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Echinococcus multilocularis	neuropeptide receptor	0.0084	0.0682	0.4628
Leishmania major	glutathione-S-transferase/glutaredoxin, putative	0.0267	0.2456	0.5
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0036	0.0028
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Echinococcus multilocularis	sex peptide receptor	0.0084	0.0682	0.4628
Echinococcus granulosus	neuropeptide Y receptor	0.0084	0.0682	0.4628
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0084	0.0682	0.4628
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Echinococcus multilocularis	neuropeptide receptor A26	0.0084	0.0682	0.4628
Echinococcus granulosus	neuropeptide FF receptor 2	0.0084	0.0682	0.4628
Echinococcus granulosus	serotonin receptor	0.0084	0.0682	0.4628
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0084	0.0682	0.1473
Schistosoma mansoni	hypothetical protein	0.0084	0.0682	0.1473
Schistosoma mansoni	cell adhesion molecule	0.0015	0.0008	0.0017
Onchocerca volvulus		0.0167	0.1484	0.452
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Schistosoma mansoni	hypothetical protein	0.0084	0.0682	0.1473
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Loa Loa (eye worm)	TK/KIN16 protein kinase	0.0184	0.1655	0.1649
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0084	0.0682	0.4628
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.0084	0.0682	0.0675
Echinococcus multilocularis	g protein coupled receptor	0.0084	0.0682	0.4628
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0084	0.0682	0.4628
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0084	0.0682	0.4628
Echinococcus multilocularis	serotonin receptor	0.0084	0.0682	0.4628
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Echinococcus multilocularis	neuropeptide Y receptor	0.0084	0.0682	0.4628
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0036	0.0028
Echinococcus granulosus	orexin receptor type 2	0.0084	0.0682	0.4628
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Schistosoma mansoni	microsomal glutathione s-transferase	0.0112	0.0955	0.2063
Schistosoma mansoni	amine GPCR	0.0084	0.0682	0.1473
Schistosoma mansoni	membrane associated proteins in eicosanoid and glutathione metabolism family member	0.049	0.4631	1
Echinococcus multilocularis	g-protein coupled receptor	0.0084	0.0682	0.4628
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0084	0.0682	0.1473
Echinococcus granulosus	g-protein coupled receptor	0.0084	0.0682	0.4628
Echinococcus multilocularis	neuropeptides capa receptor	0.0084	0.0682	0.4628
Echinococcus multilocularis	fmrfamide receptor	0.0084	0.0682	0.4628
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0084	0.0682	0.1473
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0084	0.0682	0.4628
Schistosoma mansoni	neuropeptide f receptor 76f	0.0084	0.0682	0.1473
Schistosoma mansoni	biogenic amine receptor	0.0084	0.0682	0.1473
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.0084	0.0682	0.0675
Schistosoma mansoni	amine GPCR	0.0084	0.0682	0.1473
Echinococcus granulosus	dro:myosuppressin receptor	0.0084	0.0682	0.4628
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0084	0.0682	0.1473
Echinococcus multilocularis	neuropeptide receptor	0.0084	0.0682	0.4628
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0084	0.0682	0.4628
Echinococcus granulosus	biogenic amine 5HT receptor	0.0084	0.0682	0.4628
Schistosoma mansoni	fatty acid binding protein	0.0166	0.1474	0.3182
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0084	0.0682	0.4628
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0084	0.0682	0.0675
Echinococcus multilocularis	fatty acid binding protein FABP2	0.0166	0.1474	1
Schistosoma mansoni	histamine h1 receptor	0.0084	0.0682	0.1473
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0084	0.0682	0.4628
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Echinococcus granulosus	roundabout 2	0.0018	0.0036	0.0242
Echinococcus granulosus	neuropeptide receptor	0.0084	0.0682	0.4628
Echinococcus granulosus	rhodopsin orphan GPCR	0.0084	0.0682	0.4628
Trypanosoma cruzi	glutathione-S-transferase/glutaredoxin, putative	0.0267	0.2456	0.5
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0084	0.0682	0.0675
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0084	0.0682	0.1473
Loa Loa (eye worm)	G-protein coupled receptor	0.0084	0.0682	0.0675
Onchocerca volvulus	Tyrosine kinase homolog	0.0172	0.1538	0.4826
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0084	0.0682	0.4628
Echinococcus granulosus	neurotracting:lsamp:neurotrimin:obcam	0.0015	0.0008	0.0052
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0084	0.0682	0.1473
Schistosoma mansoni	hypothetical protein	0.0084	0.0682	0.1473
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Onchocerca volvulus		0.0267	0.2456	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.0084	0.0682	0.4628
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0084	0.0682	0.4628
Echinococcus granulosus	neuropeptides capa receptor	0.0084	0.0682	0.4628
Echinococcus granulosus	fmrfamide receptor	0.0084	0.0682	0.4628
Echinococcus multilocularis	somatostatin receptor	0.0084	0.0682	0.4628
Echinococcus granulosus	tm gpcr rhodopsin	0.0084	0.0682	0.4628
Echinococcus granulosus	rhodopsin orphan GPCR	0.0084	0.0682	0.4628
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0084	0.0682	0.4628
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0084	0.0682	0.1473
Schistosoma mansoni	opsin-like receptor	0.0084	0.0682	0.1473
Echinococcus multilocularis	g protein coupled receptor	0.0084	0.0682	0.4628
Echinococcus granulosus	neuropeptide receptor A26	0.0084	0.0682	0.4628
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0084	0.0682	0.4628
Echinococcus granulosus	g protein coupled receptor	0.0084	0.0682	0.4628
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0084	0.0682	0.1473
Schistosoma mansoni	biogenic amine receptor	0.0084	0.0682	0.1473
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0084	0.0682	0.1473
Echinococcus multilocularis	orexin receptor type 2	0.0084	0.0682	0.4628
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0084	0.0682	0.1473
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0084	0.0682	0.4628
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0084	0.0682	0.4628
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0084	0.0682	0.1473
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0084	0.0682	0.1473
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Echinococcus granulosus	tm gpcr rhodopsin	0.0084	0.0682	0.4628
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0084	0.0682	0.4628
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0184	0.1655	0.1044
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0084	0.0682	0.1473
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Loa Loa (eye worm)	neuropeptide F receptor	0.0084	0.0682	0.0675
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Schistosoma mansoni	biogenic amine receptor	0.0084	0.0682	0.1473
Loa Loa (eye worm)	G-protein coupled receptor	0.0084	0.0682	0.0675
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0084	0.0682	0.4628
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0084	0.0682	0.1473
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0084	0.0682	0.4628
Schistosoma mansoni	neuropeptide receptor	0.0084	0.0682	0.1473
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Echinococcus multilocularis	roundabout 2	0.0018	0.0036	0.0242
Echinococcus multilocularis	dro:myosuppressin receptor	0.0084	0.0682	0.4628
Schistosoma mansoni	hypothetical protein	0.0084	0.0682	0.1473
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0084	0.0682	0.4628
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0084	0.0682	0.1473
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0084	0.0682	0.1473
Schistosoma mansoni	amine GPCR	0.0084	0.0682	0.1473
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Echinococcus granulosus	g protein coupled receptor	0.0084	0.0682	0.4628
Trypanosoma cruzi	glutathione-S-transferase/glutaredoxin, putative	0.0267	0.2456	0.5
Schistosoma mansoni	neuropeptide receptor	0.0084	0.0682	0.1473
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Loa Loa (eye worm)	lipocalin/cytosolic fatty-acid binding protein family protein	0.1042	1	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0084	0.0682	0.1473
Echinococcus granulosus	somatostatin receptor	0.0084	0.0682	0.4628
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0084	0.0682	0.4628
Loa Loa (eye worm)	hypothetical protein	0.0267	0.2456	0.245
Echinococcus multilocularis	fatty acid binding protein FABP2	0.0065	0.0498	0.338
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Toxoplasma gondii	prostaglandin-E synthase	0.0267	0.2456	1
Echinococcus granulosus	fatty acid binding protein, adipocyte	0.0065	0.0498	0.338
Echinococcus granulosus	rhodopsin orphan GPCR	0.0084	0.0682	0.4628
Schistosoma mansoni	growth hormone secretagogue receptor	0.0084	0.0682	0.1473
Trypanosoma brucei	Prostaglandin E synthase	0.0267	0.2456	0.5
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0084	0.0682	0.4628
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0084	0.0682	0.4628
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0084	0.0682	0.1473
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0084	0.0682	0.4628
Echinococcus multilocularis	allatostatin A receptor	0.0084	0.0682	0.4628
Echinococcus multilocularis	fatty acid binding protein FABP2	0.0166	0.1474	1
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0084	0.0682	0.1473
Echinococcus granulosus	rhodopsin orphan GPCR	0.0084	0.0682	0.4628
Loa Loa (eye worm)	neuropeptide F receptor	0.0084	0.0682	0.0675
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Echinococcus granulosus	G protein coupled receptor 139	0.0084	0.0682	0.4628
Schistosoma mansoni	opsin-like receptor	0.0084	0.0682	0.1473
Schistosoma mansoni	amine GPCR	0.0084	0.0682	0.1473
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0084	0.0682	0.4628
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0084	0.0682	0.4628
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0084	0.0682	0.4628
Echinococcus multilocularis	microsomal glutathione S transferase 3	0.0112	0.0955	0.6483
Echinococcus granulosus	rhodopsin orphan GPCR	0.0084	0.0682	0.4628
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0084	0.0682	0.4628
Echinococcus multilocularis	neuropeptides capa receptor	0.0084	0.0682	0.4628
Loa Loa (eye worm)	TYRA-2 protein	0.0084	0.0682	0.0675
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0084	0.0682	0.1473
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0084	0.0682	0.0675
Schistosoma mansoni	amine GPCR	0.0084	0.0682	0.1473
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0084	0.0682	0.1473
Echinococcus granulosus	microsomal glutathione S transferase 3	0.0112	0.0955	0.6483
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0084	0.0682	0.1473
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Echinococcus granulosus	g protein coupled receptor	0.0084	0.0682	0.4628
Echinococcus granulosus	hypothetical protein	0.0084	0.0682	0.4628
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Echinococcus granulosus	7tm_1 domain containing protein	0.0084	0.0682	0.4628
Schistosoma mansoni	neuropeptide receptor	0.0084	0.0682	0.1473
Echinococcus multilocularis	G protein coupled receptor 139	0.0084	0.0682	0.4628
Echinococcus multilocularis	neuropeptide s receptor	0.0084	0.0682	0.4628
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0084	0.0682	0.4628
Schistosoma mansoni	neuropeptide F-like receptor	0.0084	0.0682	0.1473
Echinococcus granulosus	fatty acid binding protein FABP2	0.0166	0.1474	1
Schistosoma mansoni	neuropeptide F-like receptor	0.0084	0.0682	0.1473
Echinococcus multilocularis	g protein coupled receptor	0.0084	0.0682	0.4628
Echinococcus granulosus	7TM GPCR rhodopsin	0.0084	0.0682	0.4628
Echinococcus granulosus	neuropeptide receptor	0.0084	0.0682	0.4628
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Echinococcus granulosus	fatty acid binding protein FABP2	0.0065	0.0498	0.338
Echinococcus granulosus	sex peptide receptor	0.0084	0.0682	0.4628
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0084	0.0682	0.1473
Echinococcus granulosus	neuropeptide Y receptor	0.0084	0.0682	0.4628
Schistosoma mansoni	opsin-like receptor	0.0084	0.0682	0.1473
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0084	0.0682	0.4628
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0084	0.0682	0.4628
Echinococcus granulosus	allatostatin A receptor	0.0084	0.0682	0.4628
Echinococcus granulosus	rhodopsin orphan GPCR	0.0084	0.0682	0.4628
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0084	0.0682	0.1473
Echinococcus granulosus	neuropeptide s receptor	0.0084	0.0682	0.4628
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Echinococcus granulosus	fatty acid binding protein FABP2	0.0166	0.1474	1
Schistosoma mansoni	neuropeptide receptor	0.0084	0.0682	0.1473
Echinococcus multilocularis	fmrfamide receptor	0.0084	0.0682	0.4628
Echinococcus multilocularis	neuropeptide Y receptor	0.0084	0.0682	0.4628
Echinococcus granulosus	neuropeptides capa receptor	0.0084	0.0682	0.4628
Loa Loa (eye worm)	melatonin receptor type 1A	0.0084	0.0682	0.0675
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0084	0.0682	0.1473
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0084	0.0682	0.4628
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0084	0.0682	0.4628
Brugia malayi	hypothetical protein	0.0267	0.2456	0.1904
Schistosoma mansoni	fatty acid binding protein	0.0166	0.1474	0.3182
Echinococcus granulosus	tm gpcr rhodopsin	0.0084	0.0682	0.4628
Echinococcus multilocularis	serotonin receptor	0.0084	0.0682	0.4628
Echinococcus granulosus	biogenic amine 5HT receptor	0.0084	0.0682	0.4628
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0682	0.0675
Schistosoma mansoni	adenoreceptor	0.0084	0.0682	0.1473
Schistosoma mansoni	myosin xvIII	0.0084	0.0682	0.1473
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0084	0.0682	0.4628

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 1000 nM	Inhibition of RET kinase	ChEMBL.	21724393
IC50 (binding)	= 0.062 uM	Inhibition of VEGFR2	ChEMBL.	16979339
IC50 (binding)	= 0.062 uM	Inhibition of VEGFR2	ChEMBL.	16979339
IC50 (functional)	= 0.3 uM	Antiproliferative activity against A375 cells	ChEMBL.	16979339
IC50 (functional)	= 0.3 uM	Antiproliferative activity against A375 cells	ChEMBL.	16979339
IC50 (functional)	= 0.346 uM	Antiproliferative activity against HeLa cells	ChEMBL.	16979339
IC50 (functional)	= 0.346 uM	Antiproliferative activity against HeLa cells	ChEMBL.	16979339
IC50 (functional)	= 0.438 uM	Antiproliferative activity against HCT116 cells	ChEMBL.	16979339
IC50 (functional)	= 0.438 uM	Antiproliferative activity against HCT116 cells	ChEMBL.	16979339

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	ChEMBL23	16979339

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: CHEMBL220951
PubChem: 23646065

Bibliographic References

2 literature references were collected for this gene.

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Detailed information for compound 414034