TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 521.605 | Formula: C29H35N3O6
H donors: 1 H acceptors: 2 LogP: 3.3 Rotable bonds: 9
Rule of 5 violations (Lipinski): 2
SMILES: CC(COc1cc(ccc1NC(=O)CN1CCOCC1)c1cccc2c1oc(cc2=O)N1CCOCC1)C
InChi: 1S/C29H35N3O6/c1-20(2)19-37-26-16-21(6-7-24(26)30-27(34)18-31-8-12-35-13-9-31)22-4-3-5-23-25(33)17-28(38-29(22)23)32-10-14-36-15-11-32/h3-7,16-17,20H,8-15,18-19H2,1-2H3,(H,30,34)
InChiKey: JNRPKMKRMUTLDI-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	phosphatidylinositol-4,5-bisphosphate 3-kinase, catalytic subunit alpha	Starlite/ChEMBL	References
Homo sapiens	protein kinase, DNA-activated, catalytic polypeptide	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Entamoeba histolytica	hypothetical protein	Get druggable targets OG5_127444	All targets in OG5_127444
Echinococcus granulosus	DNA dependent protein kinase catalytic subunit	Get druggable targets OG5_132688	All targets in OG5_132688
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Echinococcus multilocularis	DNA dependent protein kinase catalytic subunit	Get druggable targets OG5_132688	All targets in OG5_132688
Entamoeba histolytica	phosphatidylinositol 3-kinase, 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
Leishmania mexicana	phosphatidylinositol 3-kinase, 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
Entamoeba histolytica	phosphatidylinositol 3-kinase 1, putative	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
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	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
Echinococcus multilocularis	phosphatidylinositol 4,5 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
Loa Loa (eye worm)	hypothetical protein	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
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, 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
Leishmania infantum	phosphatidylinositol 3-kinase 2, 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 granulosus	phosphatidylinositol 45 bisphosphate 3 kinase	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
Trichomonas vaginalis	phosphatidylinositol kinase, putative	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

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	phosphatidylinositol-4,5-bisphosphate 3-kinase, catalytic subunit alpha	1068 aa	927 aa	29.0 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Trypanosoma cruzi	synaptotagmin, putative	0.005	0.0501	0.1627
Brugia malayi	calpain 5	0.005	0.0501	0.0729
Trichomonas vaginalis	splicing factor 3A subunit, putative	0.005	0.0501	0.0808
Loa Loa (eye worm)	hypothetical protein	0.005	0.0501	0.0845
Brugia malayi	C2 domain containing protein	0.005	0.0501	0.0729
Plasmodium vivax	perforin-like protein 1	0.0175	0.4943	1
Brugia malayi	Variant SH3 domain containing protein	0.005	0.0501	0.0729
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0501	0.0808
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0501	0.0808
Trichomonas vaginalis	synaptotagmin, putative	0.005	0.0501	0.0808
Loa Loa (eye worm)	C2 domain-containing protein	0.005	0.0501	0.0845
Trichomonas vaginalis	synaptotagmin 1,2, putative	0.005	0.0501	0.0808
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0501	0.0808
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0501	0.0808
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0122	0.3076	1
Entamoeba histolytica	C2 domain containing protein	0.005	0.0501	0.0808
Brugia malayi	Synapse defective protein 1	0.005	0.0501	0.0729
Plasmodium vivax	perforin-like protein 2	0.0175	0.4943	1
Trypanosoma cruzi	hypothetical protein, conserved	0.005	0.0501	0.1627
Loa Loa (eye worm)	hypothetical protein	0.005	0.0501	0.0845
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.005	0.0501	0.0808
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0501	0.0808
Loa Loa (eye worm)	hypothetical protein	0.0081	0.1593	0.2688
Entamoeba histolytica	C2 domain containing protein	0.005	0.0501	0.0808
Entamoeba histolytica	hypothetical protein	0.005	0.0501	0.0808
Giardia lamblia	Phosphoinositide-3-kinase, catalytic, alpha polypeptide	0.0061	0.0898	0.5
Brugia malayi	C2 domain containing protein	0.005	0.0501	0.0729
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0131	0.3377	1
Plasmodium vivax	perforin-like protein 4	0.0175	0.4943	1
Trichomonas vaginalis	synaptotagmin, putative	0.005	0.0501	0.0808
Echinococcus multilocularis	DNA dependent protein kinase catalytic subunit	0.0317	1	1
Trypanosoma cruzi	cytoskeleton associated protein, putative	0.005	0.0501	0.1627
Trypanosoma brucei	C2 domain containing protein, putative	0.005	0.0501	1
Trypanosoma cruzi	hypothetical protein, conserved	0.005	0.0501	0.1627
Leishmania major	hypothetical protein, conserved	0.0117	0.2893	1
Loa Loa (eye worm)	phosphatidylinositol-specific phospholipase C	0.005	0.0501	0.0845
Trypanosoma brucei	hypothetical protein, conserved	0.005	0.0501	1
Entamoeba histolytica	hypothetical protein	0.005	0.0501	0.0808
Onchocerca volvulus		0.005	0.0501	0.5
Entamoeba histolytica	hypothetical protein	0.005	0.0501	0.0808
Trichomonas vaginalis	synaptotagmin, putative	0.005	0.0501	0.0808
Trichomonas vaginalis	copine, putative	0.005	0.0501	0.0808
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0057	0.0733	0.1637
Trichomonas vaginalis	copine, putative	0.005	0.0501	0.0808
Trichomonas vaginalis	calcium-dependent lipid-binding protein, putative	0.005	0.0501	0.0808
Loa Loa (eye worm)	hypothetical protein	0.0042	0.02	0.0337
Trichomonas vaginalis	vab10 spectraplakin, putative	0.005	0.0501	0.0808
Entamoeba histolytica	calcium-binding protein, putative	0.005	0.0501	0.0808
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0501	0.0808
Trypanosoma brucei	C2 domain containing protein, putative	0.005	0.0501	1
Loa Loa (eye worm)	C2 domain-containing protein	0.005	0.0501	0.0845
Entamoeba histolytica	hypothetical protein	0.0098	0.2216	0.6931
Loa Loa (eye worm)	hypothetical protein	0.005	0.0501	0.0845
Loa Loa (eye worm)	hypothetical protein	0.005	0.0501	0.0845
Brugia malayi	Synaptotagmin I	0.005	0.0501	0.0729
Brugia malayi	Phosphatidylinositol-specific phospholipase C, X domain containing protein	0.005	0.0501	0.0729
Loa Loa (eye worm)	synaptotagmin-1	0.005	0.0501	0.0845
Echinococcus granulosus	phosphatidylinositol 45 bisphosphate 3 kinase	0.0227	0.6784	0.6615
Echinococcus multilocularis	macrophage expressed protein	0.0175	0.4943	0.4677
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0501	0.0808
Brugia malayi	C2 domain containing protein	0.005	0.0501	0.0729
Trypanosoma cruzi	hypothetical protein, conserved	0.005	0.0501	0.1627
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0227	0.6784	1
Entamoeba histolytica	DENN domain protein	0.005	0.0501	0.0808
Trypanosoma brucei	C2 domain/Ankyrin repeats (3 copies), putative	0.005	0.0501	1
Plasmodium falciparum	perforin-like protein 1	0.0175	0.4943	1
Brugia malayi	C2 domain containing protein	0.005	0.0501	0.0729
Loa Loa (eye worm)	C2 domain-containing protein	0.005	0.0501	0.0845
Onchocerca volvulus		0.005	0.0501	0.5
Plasmodium falciparum	perforin-like protein 4	0.0175	0.4943	1
Entamoeba histolytica	hypothetical protein, conserved	0.005	0.0501	0.0808
Trichomonas vaginalis	Proline-rich protein, putative	0.005	0.0501	0.0808
Onchocerca volvulus		0.005	0.0501	0.5
Loa Loa (eye worm)	phosphatidylinositol 3	0.0202	0.5924	1
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0094	0.2058	0.2479
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0501	0.0808
Loa Loa (eye worm)	C2 domain-containing protein	0.005	0.0501	0.0845
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit gamma, putative	0.0122	0.3076	1
Loa Loa (eye worm)	Nedd4-PD	0.005	0.0501	0.0845
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0098	0.2216	0.6931
Echinococcus multilocularis	phosphatidylinositol 4,5 bisphosphate 3 kinase	0.0227	0.6784	0.6615
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0501	0.0808
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0501	0.0808
Trypanosoma brucei	Coiled-coil and C2 domain-containing protein	0.005	0.0501	1
Loa Loa (eye worm)	hypothetical protein	0.005	0.0501	0.0845
Entamoeba histolytica	phosphatidylinositol 3-kinase 1, putative	0.0115	0.2802	0.9021
Trypanosoma cruzi	hypothetical protein, conserved	0.005	0.0501	0.1627
Brugia malayi	Protein kinase c protein 2	0.005	0.0501	0.0729
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0501	0.0808
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0501	0.0808
Schistosoma mansoni	hypothetical protein	0.0175	0.4943	0.707
Trypanosoma brucei	hypothetical protein, conserved	0.005	0.0501	1
Loa Loa (eye worm)	phosphatidylinositol 3-kinase catalytic subunit gamma	0.005	0.0501	0.0845
Trypanosoma cruzi	C2 domain/Ankyrin repeats (3 copies), putative	0.005	0.0501	0.1627
Plasmodium falciparum	perforin-like protein 2	0.0175	0.4943	1
Entamoeba histolytica	hypothetical protein	0.005	0.0501	0.0808
Brugia malayi	phospholipase C homolog	0.005	0.0501	0.0729
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0122	0.3076	1
Plasmodium vivax	perforin-like protein 3	0.0175	0.4943	1
Onchocerca volvulus		0.005	0.0501	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0501	0.0808
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0501	0.0808
Trypanosoma brucei	C2 domain containing protein, putative	0.005	0.0501	1
Trypanosoma brucei	C2 domain containing protein, putative	0.005	0.0501	1
Entamoeba histolytica	C2 domain containing protein	0.005	0.0501	0.0808
Trichomonas vaginalis	synaptotagmin 1, 3, C.elegans, putative	0.005	0.0501	0.0808
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0501	0.0808
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.0122	0.3076	1
Loa Loa (eye worm)	AGC/PKC/ETA protein kinase	0.005	0.0501	0.0845
Loa Loa (eye worm)	hypothetical protein	0.005	0.0501	0.0845
Trypanosoma cruzi	C2 domain containing protein, putative	0.005	0.0501	0.1627
Entamoeba histolytica	C2 domain containing protein	0.005	0.0501	0.0808
Entamoeba histolytica	C2 domain containing protein	0.005	0.0501	0.0808
Brugia malayi	C2 domain containing protein	0.005	0.0501	0.0729
Trichomonas vaginalis	synaptotagmin 1, 3, C.elegans, putative	0.005	0.0501	0.0808
Loa Loa (eye worm)	hypothetical protein	0.005	0.0501	0.0845
Loa Loa (eye worm)	hypothetical protein	0.005	0.0501	0.0845
Trypanosoma cruzi	hypothetical protein, conserved	0.005	0.0501	0.1627
Echinococcus granulosus	phosphatidylinositol 4 phosphate 3 kinase C2	0.0081	0.1593	0.115
Onchocerca volvulus	Multiple C2 domain and transmembrane region protein homolog	0.005	0.0501	0.5
Entamoeba histolytica	hypothetical protein, conserved	0.005	0.0501	0.0808
Trypanosoma cruzi	phosphoinositide-specific phospholipase C, putative	0.005	0.0501	0.1627
Loa Loa (eye worm)	C2 domain-containing protein	0.005	0.0501	0.0845
Plasmodium vivax	perforin-like protein 5	0.0175	0.4943	1
Loa Loa (eye worm)	hypothetical protein	0.005	0.0501	0.0845
Chlamydia trachomatis	hypothetical protein	0.0175	0.4943	0.5
Brugia malayi	C2 domain containing protein	0.005	0.0501	0.0729
Loa Loa (eye worm)	hypothetical protein	0.005	0.0501	0.0845
Trypanosoma cruzi	cytoskeleton associated protein, putative	0.005	0.0501	0.1627
Loa Loa (eye worm)	hypothetical protein	0.005	0.0501	0.0845
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0501	0.0808
Entamoeba histolytica	hypothetical protein	0.005	0.0501	0.0808
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0501	0.0808
Brugia malayi	protein kinase C II.	0.005	0.0501	0.0729
Loa Loa (eye worm)	variant SH3 domain-containing protein	0.005	0.0501	0.0845
Trichomonas vaginalis	synaptotagmin, putative	0.005	0.0501	0.0808
Brugia malayi	C2 domain containing protein	0.005	0.0501	0.0729
Trypanosoma brucei	cAMP binding protein, putative	0.005	0.0501	1
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0122	0.3076	1
Brugia malayi	C2 domain containing protein	0.005	0.0501	0.0729
Brugia malayi	C2 domain containing protein	0.005	0.0501	0.0729
Loa Loa (eye worm)	hypothetical protein	0.005	0.0501	0.0845
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0085	0.1757	0.5294
Loa Loa (eye worm)	hypothetical protein	0.005	0.0501	0.0845
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0501	0.0808
Brugia malayi	C2 domain containing protein	0.005	0.0501	0.0729
Loa Loa (eye worm)	AGC/PKC/ALPHA protein kinase	0.005	0.0501	0.0845
Trypanosoma brucei	predicted C2 domain protein	0.005	0.0501	1
Entamoeba histolytica	C2 domain containing protein	0.005	0.0501	0.0808
Brugia malayi	NEDD4.2	0.005	0.0501	0.0729
Entamoeba histolytica	C2 domain containing protein	0.005	0.0501	0.0808
Entamoeba histolytica	hypothetical protein	0.005	0.0501	0.0808
Trypanosoma brucei	predicted C2 domain protein	0.005	0.0501	1
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0501	0.0808
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0501	0.0808
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0122	0.3076	0.903
Onchocerca volvulus		0.005	0.0501	0.5
Toxoplasma gondii	MAC/Perforin domain-containing protein	0.0175	0.4943	1
Onchocerca volvulus		0.005	0.0501	0.5
Loa Loa (eye worm)	copine family protein	0.005	0.0501	0.0845
Loa Loa (eye worm)	hypothetical protein	0.005	0.0501	0.0845
Trypanosoma cruzi	hypothetical protein, conserved	0.011	0.2619	0.8516
Brugia malayi	C2 domain containing protein	0.005	0.0501	0.0729
Trichomonas vaginalis	ion channel nompc, putative	0.005	0.0501	0.0808
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0501	0.0808
Onchocerca volvulus	Putative cc2d1b protein	0.005	0.0501	0.5
Trypanosoma cruzi	cAMP binding protein, putative	0.005	0.0501	0.1627
Loa Loa (eye worm)	hypothetical protein	0.005	0.0501	0.0845
Echinococcus granulosus	macrophage expressed protein	0.0175	0.4943	0.4677
Loa Loa (eye worm)	C2 domain-containing protein	0.005	0.0501	0.0845
Trypanosoma cruzi	hypothetical protein, conserved	0.005	0.0501	0.1627
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0501	0.0808
Brugia malayi	C2 domain containing protein	0.005	0.0501	0.0729
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0501	0.0808
Loa Loa (eye worm)	hypothetical protein	0.005	0.0501	0.0845
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0501	0.0808
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0122	0.3076	1
Trypanosoma cruzi	Coiled-coil and C2 domain-containing protein	0.005	0.0501	0.1627
Entamoeba histolytica	C2 domain containing protein	0.005	0.0501	0.0808
Brugia malayi	Copine family protein	0.005	0.0501	0.0729
Plasmodium falciparum	perforin-like protein 5	0.0175	0.4943	1
Loa Loa (eye worm)	hypothetical protein	0.005	0.0501	0.0845
Trichomonas vaginalis	annexin VII, putative	0.005	0.0501	0.0808
Trypanosoma brucei	phosphoinositide-specific phospholipase C	0.005	0.0501	1
Trypanosoma cruzi	synaptotagmin, putative	0.005	0.0501	0.1627
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0085	0.1757	0.5294
Loa Loa (eye worm)	hypothetical protein	0.005	0.0501	0.0845
Entamoeba histolytica	protein kinase, putative	0.005	0.0501	0.0808
Loa Loa (eye worm)	hypothetical protein	0.005	0.0501	0.0845
Entamoeba histolytica	protein kinase, putative	0.005	0.0501	0.0808
Brugia malayi	C2 domain containing protein	0.005	0.0501	0.0729
Trichomonas vaginalis	synaptotagmin, putative	0.005	0.0501	0.0808
Trichomonas vaginalis	copine, putative	0.005	0.0501	0.0808
Trichomonas vaginalis	synaptotagmin, putative	0.005	0.0501	0.0808
Brugia malayi	Copine VIII	0.005	0.0501	0.0729
Trypanosoma cruzi	hypothetical protein, conserved	0.005	0.0501	0.1627
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0501	0.0808
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0501	0.0808
Echinococcus multilocularis	phosphatidylinositol 4 phosphate 3 kinase C2	0.0081	0.1593	0.115
Loa Loa (eye worm)	hypothetical protein	0.005	0.0501	0.0845
Trichomonas vaginalis	synaptotagmin 1,2, putative	0.005	0.0501	0.0808
Brugia malayi	WW domain containing protein	0.005	0.0501	0.0729
Trypanosoma brucei	synaptotagmin, putative	0.005	0.0501	1
Loa Loa (eye worm)	hypothetical protein	0.005	0.0501	0.0845
Trypanosoma cruzi	phosphatidylinositol 3-kinase vps34-like	0.0044	0.0274	0.0891
Entamoeba histolytica	C2 domain protein, putative	0.005	0.0501	0.0808
Brugia malayi	Synapse defective protein 1	0.005	0.0501	0.0729
Trichomonas vaginalis	copine, putative	0.005	0.0501	0.0808
Trichomonas vaginalis	synaptotagmin 1,2, putative	0.005	0.0501	0.0808
Onchocerca volvulus		0.005	0.0501	0.5
Trichomonas vaginalis	Circumsporozoite protein precursor, putative	0.005	0.0501	0.0808
Plasmodium falciparum	perforin-like protein 3	0.0175	0.4943	1
Toxoplasma gondii	perforin-like protein PLP1	0.0175	0.4943	1
Onchocerca volvulus		0.005	0.0501	0.5
Brugia malayi	Synaptotagmin protein 3	0.005	0.0501	0.0729
Trichomonas vaginalis	copine, putative	0.005	0.0501	0.0808
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0501	0.0808
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0501	0.0808
Trichomonas vaginalis	synaptotagmin, putative	0.005	0.0501	0.0808
Trypanosoma brucei	predicted C2 domain protein	0.005	0.0501	1
Entamoeba histolytica	Rap/Ran GTPase activating protein, putative	0.005	0.0501	0.0808
Entamoeba histolytica	C2 domain containing protein	0.005	0.0501	0.0808
Loa Loa (eye worm)	hypothetical protein	0.005	0.0501	0.0845
Brugia malayi	phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative	0.0104	0.2424	0.6931
Brugia malayi	LD23056p	0.005	0.0501	0.0729
Loa Loa (eye worm)	hypothetical protein	0.005	0.0501	0.0845
Brugia malayi	C2 domain containing protein	0.005	0.0501	0.0729

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.15 uM	Inhibition of PI3Kalpha after 80 mins	ChEMBL.	21216595
IC50 (binding)	= 0.18 uM	Inhibition of DNA-PK	ChEMBL.	21216595

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: CHEMBL1669160

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1502339