TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 426.366 | Formula: C22H14F4N4O
H donors: 1 H acceptors: 3 LogP: 4.2 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: Nc1cnc(cn1)c1ccc(cc1F)c1ccccc1Oc1ccnc(c1)C(F)(F)F
InChi: 1S/C22H14F4N4O/c23-17-9-13(5-6-16(17)18-11-30-21(27)12-29-18)15-3-1-2-4-19(15)31-14-7-8-28-20(10-14)22(24,25)26/h1-12H,(H2,27,30)
InChiKey: FGNXLLDJXIAVRS-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
Homo sapiens	arachidonate 5-lipoxygenase-activating protein	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Brugia malayi	hypothetical protein	0.0027	0.1572	0.742
Echinococcus granulosus	neuropeptide receptor A26	0.0027	0.1572	0.1572
Echinococcus granulosus	sex peptide receptor	0.0027	0.1572	0.1572
Echinococcus multilocularis	neuropeptide Y receptor	0.0027	0.1572	0.1572
Schistosoma mansoni	neuropeptide receptor	0.0027	0.1572	0.1572
Echinococcus granulosus	rhodopsin orphan GPCR	0.0027	0.1572	0.1572
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0027	0.1572	0.1572
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0027	0.1572	0.1572
Schistosoma mansoni	amine GPCR	0.0027	0.1572	0.1572
Brugia malayi	Dopamine receptor protein 2	0.0027	0.1572	0.742
Brugia malayi	hypothetical protein	0.0027	0.1572	0.742
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0027	0.1572	0.1572
Echinococcus granulosus	neuropeptide Y receptor	0.0027	0.1572	0.1572
Echinococcus granulosus	7tm_1 domain containing protein	0.0027	0.1572	0.1572
Echinococcus granulosus	serotonin receptor	0.0027	0.1572	0.1572
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0027	0.1572	0.1572
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0027	0.1572	0.1572
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0027	0.1572	0.1572
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0027	0.1572	0.1572
Echinococcus granulosus	rhodopsin orphan GPCR	0.0027	0.1572	0.1572
Loa Loa (eye worm)	CYP4Cod1	0.0011	0.0358	0.1691
Echinococcus multilocularis	neuropeptides capa receptor	0.0027	0.1572	0.1572
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.001	0.0243	0.0243
Echinococcus multilocularis	microsomal glutathione S transferase 3	0.0135	1	1
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Loa Loa (eye worm)	G-protein coupled receptor	0.0027	0.1572	0.742
Brugia malayi	hypothetical protein	0.0027	0.1572	0.742
Echinococcus multilocularis	g-protein coupled receptor	0.0027	0.1572	0.1572
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0027	0.1572	0.742
Echinococcus granulosus	hypothetical protein	0.0027	0.1572	0.1572
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0027	0.1572	0.742
Onchocerca volvulus		0.0027	0.1572	0.5
Toxoplasma gondii	MAPEG family protein	0.0135	1	0.5
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Brugia malayi	putative neuropeptide receptor NPR1	0.0027	0.1572	0.742
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0027	0.1572	0.1572
Echinococcus granulosus	neuropeptide s receptor	0.0027	0.1572	0.1572
Schistosoma mansoni	amine GPCR	0.0027	0.1572	0.1572
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0027	0.1572	0.1572
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0027	0.1572	0.1572
Echinococcus multilocularis	g protein coupled receptor	0.0027	0.1572	0.1572
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0027	0.1572	0.1572
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0027	0.1572	0.1572
Brugia malayi	Dopamine receptor	0.0027	0.1572	0.742
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0027	0.1572	0.742
Schistosoma mansoni	biogenic amine receptor	0.0027	0.1572	0.1572
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0027	0.1572	0.1572
Echinococcus granulosus	biogenic amine 5HT receptor	0.0027	0.1572	0.1572
Trypanosoma cruzi	cytochrome P450, putative	0.0011	0.0358	0.5
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0027	0.1572	0.1572
Onchocerca volvulus		0.0027	0.1572	0.5
Schistosoma mansoni	amine GPCR	0.0027	0.1572	0.1572
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0027	0.1572	0.1572
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0027	0.1572	0.1572
Echinococcus multilocularis	neuropeptide receptor	0.0027	0.1572	0.1572
Echinococcus multilocularis	voltage gated potassium channel	0.001	0.0243	0.0243
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0027	0.1572	0.1572
Brugia malayi	Melatonin receptor type 1A	0.0027	0.1572	0.742
Echinococcus granulosus	neuropeptide FF receptor 2	0.0027	0.1572	0.1572
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0027	0.1572	0.742
Brugia malayi	Serotonin receptor	0.0027	0.1572	0.742
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0027	0.1572	0.742
Brugia malayi	neuropeptide F receptor	0.0027	0.1572	0.742
Brugia malayi	putative neuropeptide receptor	0.0027	0.1572	0.742
Onchocerca volvulus		0.0027	0.1572	0.5
Echinococcus granulosus	tm gpcr rhodopsin	0.0027	0.1572	0.1572
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Schistosoma mansoni	opsin-like receptor	0.0027	0.1572	0.1572
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0032	0.1945	1
Brugia malayi	hypothetical protein	0.0027	0.1572	0.742
Brugia malayi	Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog	0.001	0.0243	0.1145
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0027	0.1572	0.1572
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Brugia malayi	sulfakinin receptor protein	0.0027	0.1572	0.742
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0027	0.1572	0.1572
Echinococcus granulosus	tm gpcr rhodopsin	0.0027	0.1572	0.1572
Onchocerca volvulus		0.0027	0.1572	0.5
Loa Loa (eye worm)	cytochrome P450 family protein	0.0011	0.0358	0.1691
Echinococcus granulosus	g protein coupled receptor	0.0027	0.1572	0.1572
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0027	0.1572	0.1572
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Onchocerca volvulus		0.0027	0.1572	0.5
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0027	0.1572	0.742
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Schistosoma mansoni	hypothetical protein	0.0027	0.1572	0.1572
Onchocerca volvulus		0.0027	0.1572	0.5
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0027	0.1572	0.1572
Onchocerca volvulus	Neuropeptide F receptor homolog	0.0027	0.1572	0.5
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.001	0.0243	0.0243
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0027	0.1572	0.1572
Schistosoma mansoni	neuropeptide receptor	0.0027	0.1572	0.1572
Brugia malayi	Serotonin receptor	0.0027	0.1572	0.742
Brugia malayi	G-protein coupled receptor	0.0027	0.1572	0.742
Brugia malayi	Dopamine receptor protein 1	0.0027	0.1572	0.742
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Echinococcus granulosus	tm gpcr rhodopsin	0.0027	0.1572	0.1572
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0027	0.1572	0.1572
Schistosoma mansoni	voltage-gated potassium channel	0.001	0.0243	0.0243
Brugia malayi	Cytochrome P450 family protein	0.0011	0.0358	0.1691
Echinococcus granulosus	fmrfamide receptor	0.0027	0.1572	0.1572
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0027	0.1572	0.1572
Schistosoma mansoni	voltage-gated potassium channel	0.0037	0.2362	0.2362
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Echinococcus multilocularis	serotonin receptor	0.0027	0.1572	0.1572
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0027	0.1572	0.1572
Echinococcus multilocularis	G protein coupled receptor 139	0.0027	0.1572	0.1572
Echinococcus multilocularis	fmrfamide receptor	0.0027	0.1572	0.1572
Echinococcus granulosus	7TM GPCR rhodopsin	0.0027	0.1572	0.1572
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0027	0.1572	0.1572
Schistosoma mansoni	hypothetical protein	0.0027	0.1572	0.1572
Schistosoma mansoni	neuropeptide receptor	0.0027	0.1572	0.1572
Echinococcus multilocularis	neuropeptide receptor A26	0.0027	0.1572	0.1572
Schistosoma mansoni	neuropeptide F-like receptor	0.0027	0.1572	0.1572
Schistosoma mansoni	opsin-like receptor	0.0027	0.1572	0.1572
Schistosoma mansoni	hypothetical protein	0.0027	0.1572	0.1572
Schistosoma mansoni	neuropeptide F-like receptor	0.0027	0.1572	0.1572
Onchocerca volvulus		0.0027	0.1572	0.5
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0027	0.1572	0.1572
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0027	0.1572	0.1572
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0027	0.1572	0.1572
Schistosoma mansoni	adenoreceptor	0.0027	0.1572	0.1572
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0027	0.1572	0.1572
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Brugia malayi	hypothetical protein	0.0027	0.1572	0.742
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0027	0.1572	0.1572
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0027	0.1572	0.1572
Echinococcus multilocularis	g protein coupled receptor	0.0027	0.1572	0.1572
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0027	0.1572	0.1572
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0027	0.1572	0.1572
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Echinococcus multilocularis	neuropeptide Y receptor	0.0027	0.1572	0.1572
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Brugia malayi	G protein-coupled receptor F59B2.13	0.0027	0.1572	0.742
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Brugia malayi	hypothetical protein	0.0027	0.1572	0.742
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0027	0.1572	0.1572
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Echinococcus granulosus	rhodopsin orphan GPCR	0.0027	0.1572	0.1572
Echinococcus granulosus	biogenic amine 5HT receptor	0.0027	0.1572	0.1572
Schistosoma mansoni	growth hormone secretagogue receptor	0.0027	0.1572	0.1572
Echinococcus granulosus	G protein coupled receptor 139	0.0027	0.1572	0.1572
Schistosoma mansoni	membrane associated proteins in eicosanoid and glutathione metabolism family member	0.0135	1	1
Schistosoma mansoni	biogenic amine receptor	0.0027	0.1572	0.1572
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.0034	0.2119	1
Schistosoma mansoni	neuropeptide receptor	0.0027	0.1572	0.1572
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Echinococcus granulosus	allatostatin A receptor	0.0027	0.1572	0.1572
Onchocerca volvulus		0.0027	0.1572	0.5
Schistosoma mansoni	microsomal glutathione s-transferase	0.0135	1	1
Brugia malayi	hypothetical protein	0.0027	0.1572	0.742
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0027	0.1572	0.1572
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Trypanosoma brucei	cytochrome P450, putative	0.0011	0.0358	0.5
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0027	0.1572	0.1572
Echinococcus granulosus	neuropeptide receptor	0.0027	0.1572	0.1572
Echinococcus granulosus	g-protein coupled receptor	0.0027	0.1572	0.1572
Schistosoma mansoni	amine GPCR	0.0027	0.1572	0.1572
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Echinococcus granulosus	rhodopsin orphan GPCR	0.0027	0.1572	0.1572
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0027	0.1572	0.1572
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0027	0.1572	0.1572
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0027	0.1572	0.1572
Echinococcus granulosus	neuropeptide receptor	0.0027	0.1572	0.1572
Echinococcus granulosus	rhodopsin orphan GPCR	0.0027	0.1572	0.1572
Schistosoma mansoni	amine GPCR	0.0027	0.1572	0.1572
Echinococcus multilocularis	orexin receptor type 2	0.0027	0.1572	0.1572
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0105	0.0495
Onchocerca volvulus		0.0027	0.1572	0.5
Loa Loa (eye worm)	neuropeptide F receptor	0.0027	0.1572	0.742
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Onchocerca volvulus		0.0027	0.1572	0.5
Echinococcus multilocularis	neuropeptide receptor	0.0027	0.1572	0.1572
Brugia malayi	GnHR receptor homolog	0.0027	0.1572	0.742
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.0027	0.1572	0.742
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0027	0.1572	0.1572
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0027	0.1572	0.1572
Brugia malayi	Cytochrome P450 family protein	0.0011	0.0358	0.1691
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0027	0.1572	0.1572
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0027	0.1572	0.742
Onchocerca volvulus	Dopamine\/Ecdysteroid receptor homolog	0.0027	0.1572	0.5
Echinococcus multilocularis	sex peptide receptor	0.0027	0.1572	0.1572
Echinococcus multilocularis	serotonin receptor	0.0027	0.1572	0.1572
Schistosoma mansoni	voltage-gated potassium channel	0.0037	0.2362	0.2362
Schistosoma mansoni	hypothetical protein	0.0027	0.1572	0.1572
Echinococcus granulosus	somatostatin receptor	0.0027	0.1572	0.1572
Echinococcus multilocularis	neuropeptide s receptor	0.0027	0.1572	0.1572
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0027	0.1572	0.1572
Echinococcus multilocularis	somatostatin receptor	0.0027	0.1572	0.1572
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Echinococcus multilocularis	fmrfamide receptor	0.0027	0.1572	0.1572
Echinococcus granulosus	g protein coupled receptor	0.0027	0.1572	0.1572
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.0027	0.1572	0.742
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Echinococcus multilocularis	dro:myosuppressin receptor	0.0027	0.1572	0.1572
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0027	0.1572	0.742
Echinococcus granulosus	voltage gated potassium channel	0.001	0.0243	0.0243
Schistosoma mansoni	histamine h1 receptor	0.0027	0.1572	0.1572
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Onchocerca volvulus		0.0027	0.1572	0.5
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0027	0.1572	0.1572
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0027	0.1572	0.1572
Brugia malayi	RE15519p	0.0027	0.1572	0.742
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0027	0.1572	0.1572
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0034	0.2119	0.2119
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0027	0.1572	0.1572
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0027	0.1572	0.1572
Onchocerca volvulus		0.0027	0.1572	0.5
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0032	0.1945	1
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0027	0.1572	0.1572
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Brugia malayi	AKH receptor	0.0027	0.1572	0.742
Echinococcus granulosus	dro:myosuppressin receptor	0.0027	0.1572	0.1572
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.0034	0.2119	1
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0027	0.1572	0.1572
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0027	0.1572	0.1572
Onchocerca volvulus		0.0027	0.1572	0.5
Trypanosoma cruzi	cytochrome P450, putative	0.0011	0.0358	0.5
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0027	0.1572	0.1572
Loa Loa (eye worm)	G-protein coupled receptor	0.0027	0.1572	0.742
Brugia malayi	neuropeptide F receptor	0.0027	0.1572	0.742
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0027	0.1572	0.1572
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0027	0.1572	0.1572
Loa Loa (eye worm)	hypothetical protein	0.0029	0.177	0.8354
Brugia malayi	G-protein coupled receptor	0.0027	0.1572	0.742
Loa Loa (eye worm)	neuropeptide F receptor	0.0027	0.1572	0.742
Onchocerca volvulus		0.0027	0.1572	0.5
Schistosoma mansoni	voltage-gated potassium channel	0.001	0.0243	0.0243
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0034	0.2119	0.2119
Schistosoma mansoni	myosin xvIII	0.0027	0.1572	0.1572
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Loa Loa (eye worm)	melatonin receptor type 1A	0.0027	0.1572	0.742
Echinococcus granulosus	g protein coupled receptor	0.0027	0.1572	0.1572
Loa Loa (eye worm)	TYRA-2 protein	0.0027	0.1572	0.742
Brugia malayi	larval opioid receptor	0.0027	0.1572	0.742
Loa Loa (eye worm)	hypothetical protein	0.001	0.0243	0.1145
Echinococcus multilocularis	neuropeptides capa receptor	0.0027	0.1572	0.1572
Brugia malayi	ORL1-like opioid receptor	0.0027	0.1572	0.742
Brugia malayi	G protein-coupled receptor	0.0027	0.1572	0.742
Loa Loa (eye worm)	cytochrome P450 family protein	0.0011	0.0358	0.1691
Echinococcus granulosus	rhodopsin orphan GPCR	0.0027	0.1572	0.1572
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0027	0.1572	0.1572
Brugia malayi	hypothetical protein	0.0027	0.1572	0.742
Brugia malayi	hypothetical protein	0.0027	0.1572	0.742
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0027	0.1572	0.742
Schistosoma mansoni	opsin-like receptor	0.0027	0.1572	0.1572
Echinococcus granulosus	neuropeptides capa receptor	0.0027	0.1572	0.1572
Echinococcus granulosus	rhodopsin orphan GPCR	0.0027	0.1572	0.1572
Mycobacterium ulcerans	cytochrome P450 185A4 Cyp185A4	0.0011	0.0358	0.5
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Brugia malayi	follicle stimulating hormone receptor	0.0027	0.1572	0.742
Onchocerca volvulus		0.0027	0.1572	0.5
Schistosoma mansoni	neuropeptide f receptor 76f	0.0027	0.1572	0.1572
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0027	0.1572	0.1572
Echinococcus multilocularis	allatostatin A receptor	0.0027	0.1572	0.1572
Echinococcus granulosus	neuropeptide Y receptor	0.0027	0.1572	0.1572
Echinococcus granulosus	neuropeptides capa receptor	0.0027	0.1572	0.1572
Schistosoma mansoni	biogenic amine receptor	0.0027	0.1572	0.1572
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0027	0.1572	0.1572
Onchocerca volvulus		0.0027	0.1572	0.5
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Loa Loa (eye worm)	hypothetical protein	0.0027	0.1572	0.742
Leishmania major	cytochrome p450-like protein	0.0011	0.0358	0.5
Echinococcus multilocularis	g protein coupled receptor	0.0027	0.1572	0.1572
Brugia malayi	hypothetical protein	0.0027	0.1572	0.742
Echinococcus granulosus	orexin receptor type 2	0.0027	0.1572	0.1572
Onchocerca volvulus		0.0027	0.1572	0.5

Activities

Activity type	Activity value	Assay description	Source	Reference
Ki (binding)	= 27.4 nM	BindingDB_Patents: Homogeneous Time Resolved Fluorescence Assay. The assay below is used to test the modulatory activity of compounds against FLAP. Human and mouse FLAP-encoding DNA was amplified by polymerase chain reaction and cloned into pFastBacl (Invitrogen) with a NH2-terminal 6-His tag for expression in Spodoptera frugiperda (Sf-9) cells. FLAP-containing membranes were prepared as was a FITC-labeled FLAP modulator [5-[({[2-(2-{3-[3-(tert-Butylsulfanyl)-1-(4-chlorobenzyl)-5-(quinolin-2-ylmethoxy)-1H-indol-2-yl]-2,2-dimethylpropanoyl}hydrazino)-2-oxoethyl]sulfanyl}acetyl)amino]-2-(6-hydroxy-3-oxo-3H-xanthen-9-yl)benzoic acid]. The FLAP binding assay is performed in HTRF format (homogeneous time resolved fluorescence). FLAP-containing membranes (1 ug/well final for human) are incubated in the presence of the HTRF ligand, [5-[({[2-(2-{3-[3-(tert-butylsulfanyl)-1-(4-chlorobenzyl)-5-(quinolin-2-ylmethoxy)-1H-indol-2-yl]-2,2-dimethylpropanoyl}hydrazino)-2-oxoethyl]sulfanyl}acetyl)amino]-2-(6-hydroxy-3-oxo-3H-xanthen-9-yl)benzoic acid].	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

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: CHEMBL3697291

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1994449