TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 409.485 | Formula: C21H27N7O2
H donors: 2 H acceptors: 4 LogP: 1.9 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: CCNC(=O)Nc1ccc(cc1)c1nc(N2CCOC[C@@H]2C)c2c(n1)n(CC)cn2
InChi: 1S/C21H27N7O2/c1-4-22-21(29)24-16-8-6-15(7-9-16)18-25-19-17(23-13-27(19)5-2)20(26-18)28-10-11-30-12-14(28)3/h6-9,13-14H,4-5,10-12H2,1-3H3,(H2,22,24,29)/t14-/m0/s1
InChiKey: RQSSERSPQAOXGS-AWEZNQCLSA-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	mechanistic target of rapamycin (serine/threonine kinase)	Starlite/ChEMBL	References
Homo sapiens	phosphatidylinositol-4,5-bisphosphate 3-kinase, catalytic subunit delta	Starlite/ChEMBL	References
Homo sapiens	phosphatidylinositol-4,5-bisphosphate 3-kinase, catalytic subunit alpha	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Trichomonas vaginalis	PIKK family atypical protein kinase	Get druggable targets OG5_127212	All targets in OG5_127212
Trichomonas vaginalis	PIKK family atypical protein kinase	Get druggable targets OG5_127212	All targets in OG5_127212
Trichomonas vaginalis	PIKK family atypical protein kinase	Get druggable targets OG5_127212	All targets in OG5_127212
Trypanosoma congolense	Phosphatidylinositol 3-kinase tor2	Get druggable targets OG5_127212	All targets in OG5_127212
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_127212	All targets in OG5_127212
Trichomonas vaginalis	PIKK family atypical protein kinase	Get druggable targets OG5_127212	All targets in OG5_127212
Candida albicans	similar to N terminal region of S. cerevisiae TOR2 (YKL203C) and TOR1 (YJR066W) putative protein/phosphatidylinositol kinases in	Get druggable targets OG5_127212	All targets in OG5_127212
Leishmania infantum	target of rapamycin (TOR) kinase 1, putative	Get druggable targets OG5_127212	All targets in OG5_127212
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, 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
Trypanosoma brucei gambiense	phosphatidylinositol 3-kinase tor, putative	Get druggable targets OG5_127212	All targets in OG5_127212
Entamoeba histolytica	FKBP-rapamycin associated protein (FRAP), putative	Get druggable targets OG5_127212	All targets in OG5_127212
Echinococcus granulosus	phosphatidylinositol 45 bisphosphate 3 kinase	Get druggable targets OG5_127444	All targets in OG5_127444
Leishmania major	target of rapamycin (TOR) kinase 2, putative	Get druggable targets OG5_127212	All targets in OG5_127212
Trypanosoma brucei gambiense	phosphatidylinositol 3 kinase, putative	Get druggable targets OG5_127212	All targets in OG5_127212
Trichomonas vaginalis	PIKK family atypical protein kinase	Get druggable targets OG5_127212	All targets in OG5_127212
Schistosoma japonicum	ko:K07203 FKBP12-rapamycin complex-associated protein, putative	Get druggable targets OG5_127212	All targets in OG5_127212
Giardia lamblia	Phosphoinositide-3-kinase, catalytic, alpha polypeptide	Get druggable targets OG5_127444	All targets in OG5_127444
Trichomonas vaginalis	PIKK family atypical protein kinase	Get druggable targets OG5_127212	All targets in OG5_127212
Schistosoma mansoni	ataxia telangiectasia mutated (atm)-related	Get druggable targets OG5_127212	All targets in OG5_127212
Trypanosoma brucei	phosphatidylinositol 3-kinase tor, putative	Get druggable targets OG5_127212	All targets in OG5_127212
Loa Loa (eye worm)	phosphatidylinositol 3	Get druggable targets OG5_127212	All targets in OG5_127212
Leishmania donovani	Phosphatidylinositol 3-kinase tor2	Get druggable targets OG5_127212	All targets in OG5_127212
Candida albicans	similar to internal region of S. cerevisiae TOR2 (YKL203C) and TOR1 (YJR066W) protein/phosphatidylinositol kinases involved in n	Get druggable targets OG5_127212	All targets in OG5_127212
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor1	Get druggable targets OG5_127212	All targets in OG5_127212
Leishmania mexicana	phosphatidylinositol 3-kinase, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Trichomonas vaginalis	PIKK family atypical protein kinase	Get druggable targets OG5_127212	All targets in OG5_127212
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Neospora caninum	Phosphatidylinositol 3-kinase tor2, related	Get druggable targets OG5_127212	All targets in OG5_127212
Trichomonas vaginalis	PIKK family atypical protein kinase	Get druggable targets OG5_127212	All targets in OG5_127212
Candida albicans	frameshifted from upstream TOR2 CDS (CaP19.1905)	Get druggable targets OG5_127212	All targets in OG5_127212
Toxoplasma gondii	target of rapamycin (TOR), putative	Get druggable targets OG5_127212	All targets in OG5_127212
Loa Loa (eye worm)	phosphatidylinositol 3	Get druggable targets OG5_127444	All targets in OG5_127444
Leishmania major	target of rapamycin (TOR) kinase 1, putative	Get druggable targets OG5_127212	All targets in OG5_127212
Entamoeba histolytica	phosphatidylinositol3-kinaseTor2, putative	Get druggable targets OG5_127212	All targets in OG5_127212
Echinococcus granulosus	FKBP12 rapamycin complex associated protein	Get druggable targets OG5_127212	All targets in OG5_127212
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Trichomonas vaginalis	PIKK family atypical protein kinase	Get druggable targets OG5_127212	All targets in OG5_127212
Trichomonas vaginalis	phosphatidylinositol kinase, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Candida albicans	frameshifted from upsteam TOR2 CDS (CaP19.9461)	Get druggable targets OG5_127212	All targets in OG5_127212
Trichomonas vaginalis	PIKK family atypical protein kinase	Get druggable targets OG5_127212	All targets in OG5_127212
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	Get druggable targets OG5_127212	All targets in OG5_127212
Trichomonas vaginalis	PIKK family atypical protein kinase	Get druggable targets OG5_127212	All targets in OG5_127212
Candida albicans	similar to N terminal region of S. cerevisiae TOR2 (YKL203C) and TOR1 (YJR066W) putative protein/phosphatidylinositol kinases in	Get druggable targets OG5_127212	All targets in OG5_127212
Trichomonas vaginalis	PIKK family atypical protein kinase	Get druggable targets OG5_127212	All targets in OG5_127212
Loa Loa (eye worm)	hypothetical 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
Trypanosoma congolense	Phosphatidylinositol 3-kinase tor1	Get druggable targets OG5_127212	All targets in OG5_127212
Leishmania infantum	target of rapamycin (TOR) kinase 2, putative	Get druggable targets OG5_127212	All targets in OG5_127212
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Leishmania mexicana	phosphatidylinositol 3-kinase (tor2)-like protein	Get druggable targets OG5_127212	All targets in OG5_127212
Trichomonas vaginalis	PIKK family atypical protein kinase	Get druggable targets OG5_127212	All targets in OG5_127212
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	Get druggable targets OG5_127212	All targets in OG5_127212
Trichomonas vaginalis	PIKK family atypical protein kinase	Get druggable targets OG5_127212	All targets in OG5_127212
Trichomonas vaginalis	PIKK family atypical protein kinase	Get druggable targets OG5_127212	All targets in OG5_127212
Trichomonas vaginalis	PIKK family atypical protein kinase	Get druggable targets OG5_127212	All targets in OG5_127212
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	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
Leishmania mexicana	phosphatidylinositol 3 kinase, putative	Get druggable targets OG5_127212	All targets in OG5_127212
Leishmania infantum	phosphatidylinositol 3-kinase 2, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Schistosoma japonicum	FKBP12-rapamycin complex-associated protein, putative	Get druggable targets OG5_127212	All targets in OG5_127212
Leishmania donovani	Phosphatidylinositol 3-kinase tor1	Get druggable targets OG5_127212	All targets in OG5_127212
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	Get druggable targets OG5_127212	All targets in OG5_127212
Leishmania braziliensis	target of rapamycin (TOR) kinase 2, putative	Get druggable targets OG5_127212	All targets in OG5_127212
Trichomonas vaginalis	PIKK family atypical protein kinase	Get druggable targets OG5_127212	All targets in OG5_127212
Trypanosoma cruzi	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
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
Schistosoma japonicum	FKBP12-rapamycin complex-associated protein, putative	Get druggable targets OG5_127212	All targets in OG5_127212
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	Get druggable targets OG5_127444	All targets in OG5_127444
Trichomonas vaginalis	PIKK family atypical protein kinase	Get druggable targets OG5_127212	All targets in OG5_127212
Giardia lamblia	GTOR	Get druggable targets OG5_127212	All targets in OG5_127212
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit gamma, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Trichomonas vaginalis	PIKK family atypical protein kinase	Get druggable targets OG5_127212	All targets in OG5_127212
Echinococcus multilocularis	FKBP12 rapamycin complex associated protein	Get druggable targets OG5_127212	All targets in OG5_127212
Trichomonas vaginalis	PIKK family atypical protein kinase	Get druggable targets OG5_127212	All targets in OG5_127212
Leishmania donovani	phosphatidylinositol 3-kinase 2, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Trichomonas vaginalis	PIKK family atypical protein kinase	Get druggable targets OG5_127212	All targets in OG5_127212
Schistosoma japonicum	FKBP12-rapamycin complex-associated protein, putative	Get druggable targets OG5_127212	All targets in OG5_127212
Trichomonas vaginalis	PIKK family atypical protein kinase	Get druggable targets OG5_127212	All targets in OG5_127212
Trichomonas vaginalis	PIKK family atypical protein kinase	Get druggable targets OG5_127212	All targets in OG5_127212
Trichomonas vaginalis	PIKK family atypical protein kinase	Get druggable targets OG5_127212	All targets in OG5_127212
Trichomonas vaginalis	PIKK family atypical protein kinase	Get druggable targets OG5_127212	All targets in OG5_127212
Entamoeba histolytica	phosphatidylinositol 3-kinase 1, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Candida albicans	similar to internal region of S. cerevisiae TOR2 (YKL203C) and TOR1 (YJR066W) protein/phosphatidylinositol kinases involved in n	Get druggable targets OG5_127212	All targets in OG5_127212
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor2	Get druggable targets OG5_127212	All targets in OG5_127212

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
Entamoeba histolytica	hypothetical protein	0.0192	0.0318	0.0922
Trichomonas vaginalis	lipoate-protein ligase, putative	0.0314	0.0568	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0047	0.0023	0.04
Trypanosoma cruzi	carnitine/choline acetyltransferase, putative	0.0128	0.0187	0.0752
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0047	0.0023	0.04
Echinococcus granulosus	carnitine O palmitoyltransferase 2	0.0128	0.0187	0.0471
Trypanosoma cruzi	choline/carnitine O-acyltransferase, putative	0.0128	0.0187	0.0752
Entamoeba histolytica	hypothetical protein, conserved	0.1476	0.2945	1
Trypanosoma cruzi	hypothetical protein, conserved	0.0128	0.0187	0.0752
Brugia malayi	lipoate-protein ligase B containing protein	0.0314	0.0568	0.1813
Brugia malayi	Choline/Carnitine o-acyltransferase family protein	0.0128	0.0187	0.0478
Plasmodium falciparum	biotin protein ligase, putative	0.1083	0.214	1
Loa Loa (eye worm)	phosphatidylinositol 3	0.0072	0.0073	0.0078
Brugia malayi	Choline/Carnitine o-acyltransferase family protein	0.0128	0.0187	0.0478
Leishmania major	carnitine/choline acetyltransferase, putative	0.0128	0.0187	0.0752
Entamoeba histolytica	hypothetical protein, conserved	0.1476	0.2945	1
Giardia lamblia	Hypothetical protein	0.1083	0.214	1
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.0061	0.0051	0.0107
Schistosoma mansoni	biotin-protein ligase	0.1476	0.2945	1
Loa Loa (eye worm)	choline/Carnitine O-acyltransferase	0.0128	0.0187	0.0478
Echinococcus multilocularis	carnitine O palmitoyltransferase 1, liver	0.0697	0.1352	0.4495
Echinococcus granulosus	choline O acetyltransferase	0.0128	0.0187	0.0471
Trypanosoma brucei	hypothetical protein, conserved	0.0128	0.0187	0.0752
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0083	0.0095	0.0153
Brugia malayi	Choline O-acetyltransferase	0.0128	0.0187	0.0478
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0047	0.0023	0.04
Mycobacterium leprae	POSSIBLE BIFUNCTIONAL PROTEIN BirA: BIOTIN OPERON REPRESSOR + BIOTIN--[ACETYL-COA-CARBOXYLASE] SYNTHETASE (BIOTIN--PROTEIN LIGAS	0.0769	0.1498	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0042	0.0012	0.0215
Leishmania major	biotin/lipoate protein ligase-like protein	0.1083	0.214	1
Loa Loa (eye worm)	hypothetical protein	0.0157	0.0246	0.0685
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0047	0.0023	0.04
Trypanosoma brucei	carnitine O-palmitoyltransferase II, putative	0.0128	0.0187	0.0752
Loa Loa (eye worm)	hypothetical protein	0.0314	0.0568	0.1813
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0108	0.0147	0.0333
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.0083	0.0095	0.0314
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0039	0.0006	0.0114
Echinococcus granulosus	N terminal of biotin protein ligase	0.1476	0.2945	1
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor1	0.0061	0.0051	0.0107
Trypanosoma cruzi	carnitine O-palmitoyltransferase II, putative	0.0128	0.0187	0.0752
Loa Loa (eye worm)	hypothetical protein	0.0128	0.0187	0.0478
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0047	0.0023	0.04
Trypanosoma cruzi	hypothetical protein, conserved	0.0128	0.0187	0.0752
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0157	0.0246	0.0685
Entamoeba histolytica	hypothetical protein, conserved	0.0707	0.1373	0.4567
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0192	0.0318	0.0922
Trichomonas vaginalis	PIKK family atypical protein kinase	0.005	0.0028	0.0501
Trichomonas vaginalis	PIKK family atypical protein kinase	0.005	0.0028	0.0501
Trypanosoma cruzi	choline/carnitine O-acetyltransferase, putative	0.0128	0.0187	0.0752
Chlamydia trachomatis	biotin synthetase	0.1083	0.214	0.6615
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0043	0.0015	0.0257
Loa Loa (eye worm)	carnitine O-palmitoyltransferase I isoform	0.0128	0.0187	0.0478
Onchocerca volvulus	Lipoyltransferase 1, mitochondrial homolog	0.0314	0.0568	1
Entamoeba histolytica	phosphatidylinositol 3-kinase 1, putative	0.023	0.0395	0.1189
Echinococcus granulosus	phosphatidylinositol 45 bisphosphate 3 kinase	0.0448	0.0843	0.2736
Trypanosoma cruzi	carnitine/choline acetyltransferase, putative	0.0128	0.0187	0.0752
Echinococcus multilocularis	N terminal of biotin protein ligase	0.1476	0.2945	1
Brugia malayi	Choline/Carnitine o-acyltransferase family protein	0.1455	0.2902	1
Trypanosoma brucei	carnitine O-palmitoyltransferase II, putative	0.0128	0.0187	0.0752
Echinococcus granulosus	octanoyltransferase mitochondrial	0.0314	0.0568	0.1787
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0047	0.0023	0.04
Schistosoma mansoni	lipoate-protein ligase B	0.0314	0.0568	0.1787
Giardia lamblia	Phosphoinositide-3-kinase, catalytic, alpha polypeptide	0.0118	0.0166	0.0575
Leishmania major	target of rapamycin (TOR) kinase 1, putative	0.0061	0.0051	0.0107
Entamoeba histolytica	hypothetical protein, conserved	0.1476	0.2945	1
Echinococcus multilocularis	biotin protein ligase	0.1083	0.214	0.722
Trypanosoma cruzi	hypothetical protein, conserved	0.0128	0.0187	0.0752
Echinococcus multilocularis	octanoyltransferase, mitochondrial	0.0314	0.0568	0.1787
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0047	0.0023	0.04
Brugia malayi	phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative	0.0208	0.0352	0.1055
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0053	0.0035	0.0615
Leishmania major	target of rapamycin (TOR) kinase 2, putative	0.0061	0.0051	0.0107
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit gamma, putative	0.024	0.0417	0.7335
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0166	0.0265	0.4669
Trypanosoma cruzi	carnitine O-acetyltransferase, putative	0.0128	0.0187	0.0752
Trichomonas vaginalis	PIKK family atypical protein kinase	0.005	0.0028	0.0501
Brugia malayi	Choline O-acetyltransferase	0.0128	0.0187	0.0478
Loa Loa (eye worm)	hypothetical protein	0.0769	0.1498	0.5075
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0036	0.0000091102	0.0002
Trypanosoma cruzi	choline/carnitine O-acyltransferase, putative	0.0697	0.1352	0.6266
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0166	0.0265	0.4669
Leishmania major	carnitine palmitoyltransferase-like protein	0.0128	0.0187	0.0752
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0083	0.0095	0.0151
Echinococcus multilocularis	carnitine O palmitoyltransferase 2	0.0128	0.0187	0.0471
Plasmodium falciparum	biotin--acetyl-CoA-carboxylase, putative	0.1083	0.214	1
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0083	0.0095	0.1669
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0083	0.0095	0.1669
Trypanosoma cruzi	hypothetical protein, conserved	0.0128	0.0187	0.0752
Mycobacterium tuberculosis	Possible bifunctional protein BirA: biotin operon repressor + biotin--[acetyl-CoA-carboxylase] synthetase (biotin--protein ligas	0.0769	0.1498	0.0986
Trypanosoma cruzi	phosphatidylinositol 3-kinase vps34-like	0.0083	0.0095	0.0314
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0036	0.0000091102	0.0002
Echinococcus multilocularis	phosphatidylinositol 4 phosphate 3 kinase C2	0.0157	0.0246	0.0674
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.024	0.0417	0.7335
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor2	0.0061	0.0051	0.0107
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.024	0.0417	0.1838
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0083	0.0095	0.0151
Toxoplasma gondii	lipoyl(octanoyl) transferase	0.0314	0.0568	1
Trypanosoma cruzi	lipoyltransferase, putative	0.0314	0.0568	0.2555
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.024	0.0417	0.7335
Entamoeba histolytica	hypothetical protein, conserved	0.1476	0.2945	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0061	0.0051	0.09
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	0.0061	0.0051	0.0107
Trichomonas vaginalis	PIKK family atypical protein kinase	0.005	0.0028	0.0501
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0039	0.0006	0.0102
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0039	0.0006	0.0114
Treponema pallidum	biotin--acetyl-CoA-carboxylase ligase	0.4926	1	0.5
Brugia malayi	lipoate-protein ligase, mitochondrial precursor, putative	0.0314	0.0568	0.1813
Echinococcus granulosus	carnitine O palmitoyltransferase 1 liver	0.0697	0.1352	0.4495
Trichomonas vaginalis	PIKK family atypical protein kinase	0.005	0.0028	0.0501
Trypanosoma cruzi	Biotin--acetyl-CoA-carboxylase ligase, putative	0.1083	0.214	1
Brugia malayi	biotin--acetyl-CoA-carboxylase ligase family protein	0.1083	0.214	0.7328
Entamoeba histolytica	hypothetical protein, conserved	0.0707	0.1373	0.4567
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.024	0.0417	0.1838
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.024	0.0417	0.1282
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0448	0.0843	0.2736
Echinococcus multilocularis	biotin protein ligase	0.1083	0.214	0.722
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0039	0.0006	0.0114
Echinococcus multilocularis	phosphatidylinositol 4,5 bisphosphate 3 kinase	0.0448	0.0843	0.2736
Trypanosoma cruzi	Biotin--acetyl-CoA-carboxylase ligase, putative	0.1083	0.214	1
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.024	0.0417	0.1263
Entamoeba histolytica	hypothetical protein, conserved	0.1476	0.2945	1
Loa Loa (eye worm)	biotin protein ligase 1	0.1083	0.214	0.7328
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0061	0.0051	0.09
Schistosoma mansoni	biotin-protein ligase	0.1083	0.214	0.722
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0036	0.0000091102	0.0002
Schistosoma mansoni	choline o-acyltransferase	0.0128	0.0187	0.0471
Plasmodium vivax	biotin--[acetyl-CoA-carboxylase] synthetase, putative	0.1083	0.214	1
Echinococcus granulosus	phosphatidylinositol 4 phosphate 3 kinase C2	0.0157	0.0246	0.0674
Loa Loa (eye worm)	phosphatidylinositol 3	0.04	0.0744	0.243
Giardia lamblia	GTOR	0.0061	0.0051	0.0024
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0096	0.0158
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.0072	0.0073	0.0212
Entamoeba histolytica	biotin--acetyl-CoA-carboxylase ligase, putative	0.1083	0.214	0.722
Onchocerca volvulus	Putative lipoyltransferase 2, mitochondrial	0.0314	0.0568	1
Schistosoma mansoni	choline o-acyltransferase	0.0128	0.0187	0.0471
Chlamydia trachomatis	hypothetical protein	0.1476	0.2945	1
Trypanosoma cruzi	hypothetical protein, conserved	0.0128	0.0187	0.0752
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0083	0.0095	0.0151
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0061	0.0051	0.09
Loa Loa (eye worm)	hypothetical protein	0.1455	0.2902	1
Entamoeba histolytica	hypothetical protein, conserved	0.1476	0.2945	1
Trypanosoma brucei	lipoyltransferase, putative	0.0314	0.0568	0.2555
Entamoeba histolytica	hypothetical protein, conserved	0.1476	0.2945	1
Mycobacterium ulcerans	bifunctional protein BirA	0.4612	0.9358	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0039	0.0006	0.0102
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0083	0.0095	0.1669
Trypanosoma brucei	Biotin--acetyl-CoA-carboxylase ligase, putative	0.1083	0.214	1
Echinococcus multilocularis	choline O acetyltransferase	0.0128	0.0187	0.0471
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0036	0.0000091102	0.0002
Trypanosoma cruzi	lipoate-protein ligase, putative	0.0314	0.0568	0.2555
Trypanosoma cruzi	choline/carnitine O-acyltransferase, putative	0.0697	0.1352	0.6266
Entamoeba histolytica	hypothetical protein, conserved	0.1476	0.2945	1
Loa Loa (eye worm)	hypothetical protein	0.0769	0.1498	0.5075
Wolbachia endosymbiont of Brugia malayi	biotin-(acetyl-CoA carboxylase) ligase	0.1083	0.214	1
Loa Loa (eye worm)	choline O-acetyltransferase	0.0128	0.0187	0.0478
Trypanosoma brucei	carnitine O-palmitoyltransferase, putative	0.0128	0.0187	0.0752
Echinococcus granulosus	5'partial\|biotin protein ligase	0.0769	0.1498	0.5
Entamoeba histolytica	hypothetical protein, conserved	0.1476	0.2945	1
Leishmania major	choline/Carnitine o-acyltransferase-like protein	0.0697	0.1352	0.6266
Trypanosoma brucei	carnitine O-acetyltransferase, putative	0.0128	0.0187	0.0752
Leishmania major	lipoate-protein ligase-like,lipoyl ligase, putative,lipoyltransferase, putative,lipoate biosynthesis protein, putative	0.0314	0.0568	0.2555

Activities

Activity type	Activity value	Assay description	Source	Reference
Ki (binding)	= 8 nM	Inhibition of human recombinant mTOR (1360-2549) expressed in insect cells assessed as phosphorylation of recombinant (GFP)-4-EBP1 after 30 mins by LanthaScreen FRET assay	ChEMBL.	23932790
Ki (binding)	= 380 nM	Displacement of TAMRA-PIP3 from PI3Kalpha GRP-1 pleckstrin homology domain (unknown origin) assessed as formation of 3,4,5-inositoltriphosphate after 30 mins by fluorescence polarization assay	ChEMBL.	23932790
Ki (binding)	= 630 nM	Displacement of TAMRA-PIP3 from PI3Kdelta GRP-1 pleckstrin homology domain (unknown origin) assessed as formation of 3,4,5-inositoltriphosphate after 30 mins by fluorescence polarization assay	ChEMBL.	23932790

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: CHEMBL2418340

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1768755