TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 419.387 | Formula: C21H15F2N7O
H donors: 2 H acceptors: 4 LogP: 2.08 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: Fc1ccc2n(c1)c(=O)c(c(n2)[C@H](Nc1ncnc2c1nc[nH]2)C)c1cccc(c1)F
InChi: 1S/C21H15F2N7O/c1-11(28-20-18-19(25-9-24-18)26-10-27-20)17-16(12-3-2-4-13(22)7-12)21(31)30-8-14(23)5-6-15(30)29-17/h2-11H,1H3,(H2,24,25,26,27,28)/t11-/m1/s1
InChiKey: RRTVCOAJMKLHDG-LLVKDONJSA-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	phosphatidylinositol-4,5-bisphosphate 3-kinase, catalytic subunit delta	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Giardia lamblia	Phosphoinositide-3-kinase, catalytic, alpha polypeptide	Get druggable targets OG5_127444	All targets in OG5_127444
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit gamma, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Loa Loa (eye worm)	phosphatidylinositol 3	Get druggable targets OG5_127444	All targets in OG5_127444
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	Get druggable targets OG5_127444	All targets in OG5_127444
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	Get druggable targets OG5_127444	All targets in OG5_127444
Echinococcus multilocularis	phosphatidylinositol 4,5 bisphosphate 3 kinase	Get druggable targets OG5_127444	All targets in OG5_127444
Leishmania donovani	phosphatidylinositol 3-kinase 2, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_127444	All targets in OG5_127444
Trichomonas vaginalis	phosphatidylinositol kinase, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Leishmania mexicana	phosphatidylinositol 3-kinase, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Entamoeba histolytica	hypothetical protein	Get druggable targets OG5_127444	All targets in OG5_127444
Schistosoma japonicum	ko:K00922 phosphatidylinositol-4,5-bisphosphate 3-kinase [EC2.7.1.153], putative	Get druggable targets OG5_127444	All targets in OG5_127444
Echinococcus granulosus	phosphatidylinositol 45 bisphosphate 3 kinase	Get druggable targets OG5_127444	All targets in OG5_127444
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Leishmania infantum	phosphatidylinositol 3-kinase 2, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Entamoeba histolytica	phosphatidylinositol 3-kinase 1, putative	Get druggable targets OG5_127444	All targets in OG5_127444

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
Schistosoma mansoni	tubulin subunit beta	0.088	1	1
Leishmania major	beta tubulin	0.088	1	1
Schistosoma mansoni	neuropeptide receptor	0.0544	0.6131	0.6112
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0544	0.6131	0.6121
Echinococcus multilocularis	neuropeptides capa receptor	0.0544	0.6131	0.6121
Trypanosoma brucei	beta tubulin	0.088	1	1
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0544	0.6131	0.6112
Schistosoma mansoni	tubulin subunit beta	0.088	1	1
Schistosoma mansoni	adenoreceptor	0.0544	0.6131	0.6112
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0544	0.6131	0.6121
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0544	0.6131	0.6112
Onchocerca volvulus		0.0544	0.6131	0.5
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Echinococcus multilocularis	dro:myosuppressin receptor	0.0544	0.6131	0.6121
Loa Loa (eye worm)	tubulin beta chain	0.088	1	1
Echinococcus multilocularis	tubulin beta 1 chain	0.088	1	1
Toxoplasma gondii	beta-1 tubulin, putative	0.088	1	1
Onchocerca volvulus		0.0544	0.6131	0.5
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0544	0.6131	0.6112
Onchocerca volvulus		0.0544	0.6131	0.5
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0544	0.6131	0.6121
Brugia malayi	Serotonin receptor	0.0544	0.6131	0.6112
Echinococcus granulosus	neuropeptides capa receptor	0.0544	0.6131	0.6121
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0544	0.6131	0.6112
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Loa Loa (eye worm)	melatonin receptor type 1A	0.0544	0.6131	0.6112
Echinococcus granulosus	neuropeptide receptor	0.0544	0.6131	0.6121
Brugia malayi	phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative	0.0104	0.107	0.1026
Loa Loa (eye worm)	BEN-1 protein	0.088	1	1
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0544	0.6131	0.6121
Echinococcus multilocularis	orexin receptor type 2	0.0544	0.6131	0.6121
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Brugia malayi	hypothetical protein	0.0544	0.6131	0.6112
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0544	0.6131	0.6121
Brugia malayi	Dopamine receptor	0.0544	0.6131	0.6112
Leishmania major	beta tubulin	0.088	1	1
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.0118	0.1232	0.1211
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Brugia malayi	larval opioid receptor	0.0544	0.6131	0.6112
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0081	0.0806	0.0783
Echinococcus multilocularis	beta tubulin	0.088	1	1
Brugia malayi	beta-tubulin, identical	0.088	1	1
Echinococcus multilocularis	neuropeptide receptor A26	0.0544	0.6131	0.6121
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Schistosoma mansoni	hypothetical protein	0.0544	0.6131	0.6112
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0544	0.6131	0.6112
Trichomonas vaginalis	tubulin, putative	0.088	1	1
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0544	0.6131	0.6112
Echinococcus multilocularis	fmrfamide receptor	0.0544	0.6131	0.6121
Trypanosoma brucei	phosphatidylinositol 4-kinase alpha, putative	0.0015	0.0049	0.0049
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0544	0.6131	0.6121
Echinococcus granulosus	Tubulin beta 2C chain	0.088	1	1
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.0544	0.6131	0.6112
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0544	0.6131	0.6121
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Echinococcus granulosus	tm gpcr rhodopsin	0.0544	0.6131	0.6121
Echinococcus multilocularis	serotonin receptor	0.0544	0.6131	0.6121
Loa Loa (eye worm)	G-protein coupled receptor	0.0544	0.6131	0.6112
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Echinococcus multilocularis	g protein coupled receptor	0.0544	0.6131	0.6121
Schistosoma mansoni	tubulin subunit beta	0.088	1	1
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Brugia malayi	G-protein coupled receptor	0.0544	0.6131	0.6112
Mycobacterium ulcerans	DNA polymerase IV	0.0013	0.0025	0.5
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0544	0.6131	0.6121
Echinococcus multilocularis	Tubulin beta 2C chain	0.088	1	1
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0544	0.6131	0.6112
Schistosoma mansoni	opsin-like receptor	0.0544	0.6131	0.6112
Brugia malayi	AKH receptor	0.0544	0.6131	0.6112
Echinococcus granulosus	biogenic amine 5HT receptor	0.0544	0.6131	0.6121
Echinococcus granulosus	phosphatidylinositol 4 kinase alpha	0.0015	0.0049	0.0024
Leishmania major	beta tubulin	0.088	1	1
Leishmania major	beta tubulin	0.088	1	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0544	0.6131	0.6121
Loa Loa (eye worm)	neuropeptide F receptor	0.0544	0.6131	0.6112
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0544	0.6131	0.6121
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Schistosoma mansoni	neuropeptide receptor	0.0544	0.6131	0.6112
Echinococcus granulosus	neuropeptide receptor	0.0544	0.6131	0.6121
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0118	0.1232	0.1211
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0544	0.6131	0.6112
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0544	0.6131	0.6112
Echinococcus granulosus	biogenic amine 5HT receptor	0.0544	0.6131	0.6121
Echinococcus multilocularis	Tubulin beta 2C chain	0.088	1	1
Echinococcus multilocularis	neuropeptide receptor	0.0544	0.6131	0.6121
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0544	0.6131	0.6121
Echinococcus multilocularis	beta tubulin	0.088	1	1
Echinococcus multilocularis	tubulin subunit beta	0.088	1	1
Brugia malayi	follicle stimulating hormone receptor	0.0544	0.6131	0.6112
Echinococcus granulosus	dro:myosuppressin receptor	0.0544	0.6131	0.6121
Echinococcus granulosus	sex peptide receptor	0.0544	0.6131	0.6121
Brugia malayi	sulfakinin receptor protein	0.0544	0.6131	0.6112
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Schistosoma mansoni	neuropeptide F-like receptor	0.0544	0.6131	0.6112
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0544	0.6131	0.6112
Plasmodium vivax	tubulin beta chain, putative	0.088	1	1
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0015	0.0049	0.0024
Echinococcus multilocularis	serotonin receptor	0.0544	0.6131	0.6121
Echinococcus granulosus	serotonin receptor	0.0544	0.6131	0.6121
Brugia malayi	RE15519p	0.0544	0.6131	0.6112
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Schistosoma mansoni	opsin-like receptor	0.0544	0.6131	0.6112
Echinococcus multilocularis	G protein coupled receptor 139	0.0544	0.6131	0.6121
Echinococcus multilocularis	sex peptide receptor	0.0544	0.6131	0.6121
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0544	0.6131	0.6121
Giardia lamblia	Beta tubulin	0.088	1	1
Onchocerca volvulus		0.0544	0.6131	0.5
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0544	0.6131	0.6121
Echinococcus granulosus	fmrfamide receptor	0.0544	0.6131	0.6121
Loa Loa (eye worm)	phosphatidylinositol 3	0.0198	0.2153	0.2114
Schistosoma mansoni	neuropeptide f receptor 76f	0.0544	0.6131	0.6112
Toxoplasma gondii	beta-tubulin, putative	0.088	1	1
Echinococcus granulosus	Tubulin beta 2C chain	0.088	1	1
Mycobacterium ulcerans	DNA polymerase IV	0.0013	0.0025	0.5
Brugia malayi	GnHR receptor homolog	0.0544	0.6131	0.6112
Echinococcus granulosus	Tubulin beta 2C chain	0.088	1	1
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.0544	0.6131	0.6112
Brugia malayi	neuropeptide F receptor	0.0544	0.6131	0.6112
Echinococcus multilocularis	allatostatin A receptor	0.0544	0.6131	0.6121
Schistosoma mansoni	amine GPCR	0.0544	0.6131	0.6112
Echinococcus granulosus	beta tubulin	0.088	1	1
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0544	0.6131	0.6121
Echinococcus multilocularis	neuropeptides capa receptor	0.0544	0.6131	0.6121
Onchocerca volvulus		0.0544	0.6131	0.5
Echinococcus multilocularis	Zinc finger, PHD finger	0.0015	0.0049	0.0024
Schistosoma mansoni	amine GPCR	0.0544	0.6131	0.6112
Trichomonas vaginalis	phosphatidylinositol 4-kinase, putative	0.0015	0.0049	0.0024
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0094	0.0954	0.091
Brugia malayi	Serotonin receptor	0.0544	0.6131	0.6112
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Giardia lamblia	Beta tubulin	0.088	1	1
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0544	0.6131	0.6112
Schistosoma mansoni	opsin-like receptor	0.0544	0.6131	0.6112
Entamoeba histolytica	tubulin family protein	0.088	1	1
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.004	0.0327	0.0279
Brugia malayi	hypothetical protein	0.0544	0.6131	0.6112
Echinococcus multilocularis	Tubulin beta 2C chain	0.088	1	1
Giardia lamblia	Phosphoinositide-3-kinase, catalytic, alpha polypeptide	0.0057	0.0528	0.0345
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit gamma, putative	0.0118	0.1232	0.1211
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0544	0.6131	0.6121
Echinococcus multilocularis	neuropeptide s receptor	0.0544	0.6131	0.6121
Loa Loa (eye worm)	TYRA-2 protein	0.0544	0.6131	0.6112
Echinococcus multilocularis	tubulin, beta 4A class IVa	0.088	1	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0013	0.0025	0.0025
Leishmania major	beta tubulin	0.088	1	1
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0544	0.6131	0.6112
Onchocerca volvulus		0.0544	0.6131	0.5
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0118	0.1232	0.1189
Brugia malayi	putative neuropeptide receptor	0.0544	0.6131	0.6112
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0544	0.6131	0.6112
Loa Loa (eye worm)	BEN-1 protein	0.088	1	1
Schistosoma mansoni	neuropeptide receptor	0.0544	0.6131	0.6112
Trypanosoma brucei	DNA polymerase IV, putative	0.0013	0.0025	0.0025
Echinococcus granulosus	neuropeptide receptor A26	0.0544	0.6131	0.6121
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Brugia malayi	hypothetical protein	0.0544	0.6131	0.6112
Leishmania major	beta tubulin	0.088	1	1
Echinococcus granulosus	phosphatidylinositol 3 kinase catalytic subunit	0.0015	0.0049	0.0024
Leishmania major	beta tubulin	0.088	1	1
Brugia malayi	hypothetical protein	0.0544	0.6131	0.6112
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0544	0.6131	0.6112
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0544	0.6131	0.6121
Trypanosoma brucei	beta tubulin	0.088	1	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.0544	0.6131	0.6121
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.004	0.0327	0.0279
Echinococcus granulosus	7tm_1 domain containing protein	0.0544	0.6131	0.6121
Onchocerca volvulus	Neuropeptide F receptor homolog	0.0544	0.6131	0.5
Echinococcus granulosus	beta tubulin	0.088	1	1
Echinococcus granulosus	neuropeptide s receptor	0.0544	0.6131	0.6121
Leishmania major	beta tubulin	0.088	1	1
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0544	0.6131	0.6121
Trypanosoma brucei	DNA polymerase kappa, putative	0.0013	0.0025	0.0025
Echinococcus granulosus	tm gpcr rhodopsin	0.0544	0.6131	0.6121
Brugia malayi	ORL1-like opioid receptor	0.0544	0.6131	0.6112
Trypanosoma brucei	DNA polymerase kappa, putative	0.0013	0.0025	0.0025
Onchocerca volvulus		0.0544	0.6131	0.5
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0544	0.6131	0.6121
Brugia malayi	hypothetical protein	0.0544	0.6131	0.6112
Onchocerca volvulus		0.0544	0.6131	0.5
Echinococcus granulosus	phosphatidylinositol 45 bisphosphate 3 kinase	0.0222	0.2431	0.2412
Echinococcus granulosus	rhodopsin orphan GPCR	0.0544	0.6131	0.6121
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Echinococcus granulosus	allatostatin A receptor	0.0544	0.6131	0.6121
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Echinococcus granulosus	tubulin subunit beta	0.088	1	1
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0544	0.6131	0.6112
Leishmania major	beta tubulin	0.088	1	1
Brugia malayi	neuropeptide F receptor	0.0544	0.6131	0.6112
Echinococcus multilocularis	g protein coupled receptor	0.0544	0.6131	0.6121
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0015	0.0049	0.0024
Loa Loa (eye worm)	neuropeptide F receptor	0.0544	0.6131	0.6112
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.004	0.0327	0.0279
Brugia malayi	hypothetical protein	0.0544	0.6131	0.6112
Schistosoma mansoni	growth hormone secretagogue receptor	0.0544	0.6131	0.6112
Loa Loa (eye worm)	beta-tubulin	0.088	1	1
Loa Loa (eye worm)	hypothetical protein	0.0077	0.0753	0.0708
Onchocerca volvulus		0.0544	0.6131	0.5
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0544	0.6131	0.6121
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0544	0.6131	0.6112
Echinococcus granulosus	rhodopsin orphan GPCR	0.0544	0.6131	0.6121
Echinococcus granulosus	hypothetical protein	0.0544	0.6131	0.6121
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0351	0.0304
Echinococcus multilocularis	somatostatin receptor	0.0544	0.6131	0.6121
Echinococcus multilocularis	Tubulin beta 2C chain	0.088	1	1
Echinococcus granulosus	tubulin beta 4A class IVa	0.088	1	1
Echinococcus multilocularis	g protein coupled receptor	0.0544	0.6131	0.6121
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.004	0.0327	0.0303
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0544	0.6131	0.6121
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0544	0.6131	0.6121
Brugia malayi	putative neuropeptide receptor NPR1	0.0544	0.6131	0.6112
Brugia malayi	hypothetical protein	0.0544	0.6131	0.6112
Entamoeba histolytica	phosphatidylinositol 3-kinase 1, putative	0.0115	0.1192	0.1149
Brugia malayi	G-protein coupled receptor	0.0544	0.6131	0.6112
Onchocerca volvulus		0.0544	0.6131	0.5
Echinococcus multilocularis	neuropeptide Y receptor	0.0544	0.6131	0.6121
Brugia malayi	Melatonin receptor type 1A	0.0544	0.6131	0.6112
Leishmania major	beta tubulin	0.088	1	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.0544	0.6131	0.6121
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0081	0.0806	0.0783
Trypanosoma brucei	DNA polymerase kappa, putative	0.0013	0.0025	0.0025
Schistosoma mansoni	neuropeptide F-like receptor	0.0544	0.6131	0.6112
Echinococcus granulosus	Tubulin beta 2C chain	0.088	1	1
Trypanosoma cruzi	beta tubulin, putative	0.088	1	1
Loa Loa (eye worm)	tubulin beta-2A chain	0.088	1	1
Onchocerca volvulus		0.0544	0.6131	0.5
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0544	0.6131	0.6121
Leishmania major	beta tubulin	0.088	1	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0544	0.6131	0.6112
Onchocerca volvulus		0.0544	0.6131	0.5
Brugia malayi	G protein-coupled receptor F59B2.13	0.0544	0.6131	0.6112
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0544	0.6131	0.6112
Leishmania major	beta tubulin	0.088	1	1
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0544	0.6131	0.6121
Loa Loa (eye worm)	tubulin beta-1 chain	0.088	1	1
Trypanosoma cruzi	phosphatidylinositol 3-kinase vps34-like	0.004	0.0327	0.0303
Echinococcus granulosus	neuropeptide Y receptor	0.0544	0.6131	0.6121
Trichomonas vaginalis	tubulin epsilon chain, putative	0.088	1	1
Brugia malayi	hypothetical protein	0.0544	0.6131	0.6112
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0544	0.6131	0.6121
Leishmania major	beta tubulin	0.088	1	1
Echinococcus granulosus	orexin receptor type 2	0.0544	0.6131	0.6121
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0118	0.1232	0.1211
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0052	0.0475	0.0428
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0544	0.6131	0.6112
Schistosoma mansoni	neuropeptide receptor	0.0544	0.6131	0.6112
Echinococcus granulosus	g protein coupled receptor	0.0544	0.6131	0.6121
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0118	0.1232	0.1211
Leishmania major	beta tubulin	0.088	1	1
Schistosoma mansoni	amine GPCR	0.0544	0.6131	0.6112
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Schistosoma mansoni	hypothetical protein	0.0544	0.6131	0.6112
Leishmania major	beta tubulin	0.088	1	1
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0544	0.6131	0.6121
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0544	0.6131	0.6112
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0544	0.6131	0.6121
Trypanosoma brucei	DNA polymerase IV, putative	0.0013	0.0025	0.0025
Echinococcus multilocularis	neuropeptide Y receptor	0.0544	0.6131	0.6121
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Onchocerca volvulus		0.0544	0.6131	0.5
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0544	0.6131	0.6121
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.004	0.0327	0.0303
Schistosoma mansoni	biogenic amine receptor	0.0544	0.6131	0.6112
Trypanosoma brucei	DNA polymerase kappa, putative	0.0013	0.0025	0.0025
Echinococcus granulosus	rhodopsin orphan GPCR	0.0544	0.6131	0.6121
Brugia malayi	Dopamine receptor protein 1	0.0544	0.6131	0.6112
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0544	0.6131	0.6112
Echinococcus granulosus	neuropeptides capa receptor	0.0544	0.6131	0.6121
Onchocerca volvulus		0.0544	0.6131	0.5
Plasmodium falciparum	tubulin beta chain	0.088	1	1
Echinococcus multilocularis	fmrfamide receptor	0.0544	0.6131	0.6121
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0544	0.6131	0.6112
Echinococcus granulosus	phosphatidylinositol 4 phosphate 3 kinase C2	0.0077	0.0753	0.073
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.004	0.0327	0.0303
Echinococcus multilocularis	Tubulin beta 2C chain	0.088	1	1
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Schistosoma mansoni	hypothetical protein	0.0544	0.6131	0.6112
Echinococcus multilocularis	phosphatidylinositol 4,5 bisphosphate 3 kinase	0.0222	0.2431	0.2412
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Trypanosoma brucei	DNA polymerase kappa, putative	0.0013	0.0025	0.0025
Giardia lamblia	Beta tubulin	0.088	1	1
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0544	0.6131	0.6112
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Loa Loa (eye worm)	G-protein coupled receptor	0.0544	0.6131	0.6112
Schistosoma mansoni	myosin xvIII	0.0544	0.6131	0.6112
Schistosoma mansoni	amine GPCR	0.0544	0.6131	0.6112
Schistosoma mansoni	tubulin subunit beta	0.088	1	1
Trypanosoma brucei	beta tubulin	0.088	1	1
Loa Loa (eye worm)	phosphatidylinositol 3	0.0036	0.0286	0.0239
Trypanosoma cruzi	phosphatidylinositol 4-kinase alpha, putative	0.0015	0.0049	0.0024
Echinococcus granulosus	rhodopsin orphan GPCR	0.0544	0.6131	0.6121
Echinococcus multilocularis	phosphatidylinositol 4 phosphate 3 kinase C2	0.0077	0.0753	0.073
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0544	0.6131	0.6112
Trichomonas vaginalis	tubulin beta chain, putative	0.088	1	1
Trypanosoma cruzi	phosphatidylinositol 4-kinase alpha, putative	0.0015	0.0049	0.0024
Trypanosoma brucei	beta tubulin	0.088	1	1
Echinococcus multilocularis	phosphatidylinositol 4 kinase alpha	0.0015	0.0049	0.0024
Trichomonas vaginalis	tubulin alpha chain, putative	0.088	1	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0544	0.6131	0.6121
Echinococcus multilocularis	neuropeptide receptor	0.0544	0.6131	0.6121
Schistosoma mansoni	biogenic amine receptor	0.0544	0.6131	0.6112
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0544	0.6131	0.6112
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0544	0.6131	0.6112
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0544	0.6131	0.6112
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0544	0.6131	0.6112
Onchocerca volvulus	Dopamine\/Ecdysteroid receptor homolog	0.0544	0.6131	0.5
Schistosoma mansoni	amine GPCR	0.0544	0.6131	0.6112
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0222	0.2431	0.2394
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0077	0.0753	0.0708
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0544	0.6131	0.6112
Schistosoma mansoni	tubulin subunit beta	0.088	1	1
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0118	0.1232	0.1189
Trypanosoma brucei	DNA polymerase kappa, putative	0.0013	0.0025	0.0025
Echinococcus granulosus	rhodopsin orphan GPCR	0.0544	0.6131	0.6121
Echinococcus granulosus	tm gpcr rhodopsin	0.0544	0.6131	0.6121
Trichomonas vaginalis	tubulin epsilon chain, putative	0.088	1	1
Leishmania major	beta tubulin	0.088	1	1
Echinococcus granulosus	g protein coupled receptor	0.0544	0.6131	0.6121
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Schistosoma mansoni	tubulin subunit beta	0.088	1	1
Echinococcus multilocularis	g-protein coupled receptor	0.0544	0.6131	0.6121
Toxoplasma gondii	beta tubulin	0.088	1	1
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Echinococcus granulosus	somatostatin receptor	0.0544	0.6131	0.6121
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Echinococcus granulosus	tubulin beta 1 chain	0.088	1	1
Echinococcus granulosus	Tubulin beta 2C chain	0.088	1	1
Brugia malayi	G protein-coupled receptor	0.0544	0.6131	0.6112
Brugia malayi	Dopamine receptor protein 2	0.0544	0.6131	0.6112
Brugia malayi	hypothetical protein	0.0544	0.6131	0.6112
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0544	0.6131	0.6112
Trypanosoma brucei	DNA polymerase kappa, putative	0.0013	0.0025	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Trichomonas vaginalis	tubulin gamma chain, putative	0.088	1	1
Schistosoma mansoni	hypothetical protein	0.0544	0.6131	0.6112
Leishmania major	beta tubulin	0.088	1	1
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.004	0.0327	0.0327
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.0036	0.0286	0.0262
Onchocerca volvulus		0.0544	0.6131	0.5
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0544	0.6131	0.6121
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0544	0.6131	0.6121
Schistosoma mansoni	histamine h1 receptor	0.0544	0.6131	0.6112
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0544	0.6131	0.6121
Echinococcus granulosus	neuropeptide FF receptor 2	0.0544	0.6131	0.6121
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0544	0.6131	0.6112
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0544	0.6131	0.6112
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Loa Loa (eye worm)	tubulin beta-4 chain	0.088	1	1
Entamoeba histolytica	hypothetical protein	0.0094	0.0954	0.091
Onchocerca volvulus		0.0544	0.6131	0.5
Onchocerca volvulus		0.0544	0.6131	0.5
Echinococcus granulosus	g-protein coupled receptor	0.0544	0.6131	0.6121
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0544	0.6131	0.6112
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.004	0.0327	0.0279
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Brugia malayi	hypothetical protein	0.0544	0.6131	0.6112
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0544	0.6131	0.6121
Echinococcus granulosus	7TM GPCR rhodopsin	0.0544	0.6131	0.6121
Schistosoma mansoni	biogenic amine receptor	0.0544	0.6131	0.6112
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Echinococcus granulosus	neuropeptide Y receptor	0.0544	0.6131	0.6121
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0544	0.6131	0.6112
Echinococcus granulosus	G protein coupled receptor 139	0.0544	0.6131	0.6121
Trypanosoma brucei	DNA polymerase kappa, putative	0.0013	0.0025	0.0025
Entamoeba histolytica	tubulin family protein	0.088	1	1
Leishmania major	beta tubulin	0.088	1	1
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0544	0.6131	0.6121
Echinococcus granulosus	g protein coupled receptor	0.0544	0.6131	0.6121
Loa Loa (eye worm)	hypothetical protein	0.0544	0.6131	0.6112

Activities

Activity type	Activity value	Assay description	Source	Reference
Ki (binding)	= 19840 nM	BindingDB_Patents: Alphascreen Assays. A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Ka, PI3Kß, PI3K¿, and PI3Kd. Enzyme reaction buffer was prepared using sterile water (Baxter, Deerfield, Ill.) and 50 mM Tris HCl pH 7, 14 mM MgCl2, 2 mM sodium cholate, and 100 mM NaCl. 2 mM DTT was added fresh the day of the experiment. The Alphascreen buffer was made using sterile water and 10 mM Tris HCl pH 7.5, 150 mM NaCl, 0.10% Tween 20, and 30 mM EDTA. 1 mM DTT was added fresh the day of the experiment. Compound source plates used for this assay were 384-well Greiner clear polypropylene plates containing test compounds at 5 mM and diluted 1:2 over 22 concentrations.	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.

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: CHEMBL3680931

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1976729