TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 411.497 | Formula: C22H29N5O3
H donors: 2 H acceptors: 5 LogP: 1.26 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: CO[C@@H]1CC[C@@H](CC1)CN1CC(=O)Nc2c1nc(cn2)c1ccc(nc1)C(O)(C)C
InChi: 1S/C22H29N5O3/c1-22(2,29)18-9-6-15(10-23-18)17-11-24-20-21(25-17)27(13-19(28)26-20)12-14-4-7-16(30-3)8-5-14/h6,9-11,14,16,29H,4-5,7-8,12-13H2,1-3H3,(H,24,26,28)/t14-,16+
InChiKey: NPBANVRWVVVQJV-FZNQNYSPSA-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 alpha	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma japonicum	FKBP12-rapamycin complex-associated protein, putative	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
Giardia lamblia	Phosphoinositide-3-kinase, catalytic, alpha polypeptide	Get druggable targets OG5_127444	All targets in OG5_127444
Trypanosoma brucei	phosphatidylinositol 3-kinase tor, 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	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
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	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
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	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
Giardia lamblia	GTOR	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
Neospora caninum	Phosphatidylinositol 3-kinase tor2, related	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
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	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
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
Leishmania infantum	phosphatidylinositol 3-kinase 2, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Schistosoma mansoni	ataxia telangiectasia mutated (atm)-related	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
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
Echinococcus granulosus	phosphatidylinositol 45 bisphosphate 3 kinase	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
Candida albicans	frameshifted from upstream TOR2 CDS (CaP19.1905)	Get druggable targets OG5_127212	All targets in OG5_127212
Leishmania mexicana	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
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
Trichomonas vaginalis	PIKK family atypical protein kinase	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
Echinococcus multilocularis	phosphatidylinositol 4,5 bisphosphate 3 kinase	Get druggable targets OG5_127444	All targets in OG5_127444
Schistosoma japonicum	ko:K07203 FKBP12-rapamycin complex-associated protein, putative	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
Loa Loa (eye worm)	hypothetical protein	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
Trypanosoma brucei gambiense	phosphatidylinositol 3-kinase tor, putative	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
Leishmania donovani	Phosphatidylinositol 3-kinase tor1	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
Trichomonas vaginalis	PIKK family atypical protein kinase	Get druggable targets OG5_127212	All targets in OG5_127212
Trypanosoma congolense	Phosphatidylinositol 3-kinase tor1	Get druggable targets OG5_127212	All targets in OG5_127212
Leishmania major	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
Leishmania donovani	phosphatidylinositol 3-kinase 2, 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
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Entamoeba histolytica	FKBP-rapamycin associated protein (FRAP), putative	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
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
Echinococcus granulosus	FKBP12 rapamycin complex associated protein	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
Trichomonas vaginalis	PIKK family atypical protein kinase	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
Leishmania donovani	Phosphatidylinositol 3-kinase tor2	Get druggable targets OG5_127212	All targets in OG5_127212
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Leishmania infantum	target of rapamycin (TOR) kinase 1, 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
Candida albicans	frameshifted from upsteam TOR2 CDS (CaP19.9461)	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
Echinococcus multilocularis	FKBP12 rapamycin complex associated protein	Get druggable targets OG5_127212	All targets in OG5_127212
Leishmania major	target of rapamycin (TOR) kinase 1, putative	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
Entamoeba histolytica	phosphatidylinositol3-kinaseTor2, 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
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
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
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, 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
Entamoeba histolytica	phosphatidylinositol 3-kinase 1, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Trypanosoma brucei gambiense	phosphatidylinositol 3 kinase, putative	Get druggable targets OG5_127212	All targets in OG5_127212
Leishmania mexicana	phosphatidylinositol 3-kinase (tor2)-like protein	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
Brugia malayi	phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative	0.0104	0.3908	0.4002
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0122	0.4789	1
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0085	0.2936	0.5839
Loa Loa (eye worm)	hypothetical protein	0.0208	0.9088	1
Trypanosoma cruzi	phosphatidylinositol 3-kinase vps34-like	0.0043	0.0851	0.0817
Giardia lamblia	GTOR	0.0058	0.1587	0.783
Loa Loa (eye worm)	acetylcholinesterase 1	0.0208	0.9088	1
Trypanosoma brucei	FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative	0.0065	0.1956	1
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase, putative	0.0065	0.1956	0.3394
Leishmania major	target of rapamycin (TOR) kinase 2, putative	0.0058	0.1587	0.5999
Loa Loa (eye worm)	hypothetical protein	0.0056	0.1508	0.1222
Echinococcus multilocularis	acetylcholinesterase	0.0208	0.9088	0.9044
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0044	0.0892	0.1248
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0782	0.0381
Trypanosoma brucei	target of rapamycin kinase 3, putative	0.0047	0.1034	0.5286
Loa Loa (eye worm)	hypothetical protein	0.008	0.2704	0.2608
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0043	0.0851	0.1157
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0122	0.4789	0.5022
Loa Loa (eye worm)	FKBP5 protein	0.0065	0.1956	0.1741
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0208	0.9088	0.9044
Echinococcus multilocularis	carboxylesterase 5A	0.0208	0.9088	0.9044
Mycobacterium tuberculosis	Carboxylesterase LipT	0.0035	0.0453	0.5
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.008	0.2704	0.2608
Giardia lamblia	70 kDa peptidylprolyl isomerase, putative	0.0065	0.1956	1
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.0058	0.1587	0.8114
Entamoeba histolytica	phosphatidylinositol3-kinaseTor2, putative	0.0058	0.1587	0.1869
Leishmania major	fk506-binding protein 1-like protein	0.0065	0.1956	1
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor2	0.0058	0.1587	0.2533
Echinococcus granulosus	peptidyl prolyl cis trans isomerase FKBP4	0.0065	0.1956	0.1575
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0035	0.0453	0.5
Trichomonas vaginalis	spcc417.12 protein, putative	0.0035	0.0453	0.0262
Onchocerca volvulus		0.0035	0.0453	0.5
Trichomonas vaginalis	carboxylesterase domain containing protein, putative	0.0035	0.0453	0.0262
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0085	0.2936	0.5839
Entamoeba histolytica	peptidyl-prolyl cis-trans isomerase, FKBP-type , putative	0.0065	0.1956	0.2806
Loa Loa (eye worm)	phosphatidylinositol 3	0.0202	0.8792	0.9657
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0043	0.0851	0.0418
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0047	0.1032	0.1562
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase, putative	0.0065	0.1956	0.3394
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor1	0.0058	0.1587	0.2533
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0033	0.0338	0.0005
Brugia malayi	Carboxylesterase family protein	0.0208	0.9088	1
Entamoeba histolytica	FKBP-rapamycin associated protein (FRAP), putative	0.0058	0.1587	0.1869
Leishmania major	target of rapamycin (TOR) kinase 1, putative	0.0058	0.1587	0.5999
Trichomonas vaginalis	PIKK family atypical protein kinase	0.005	0.119	0.1918
Entamoeba histolytica	hypothetical protein	0.0098	0.358	0.6931
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0044	0.0892	0.1248
Loa Loa (eye worm)	phosphatidylinositol 3	0.0036	0.0501	0.0056
Loa Loa (eye worm)	FKBP-type peptidyl-prolyl cis-trans isomerase-12	0.0065	0.1956	0.1741
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0043	0.0851	0.1157
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0036	0.0495	0.0356
Trypanosoma brucei	phosphatidylinositol 3-kinase tor, putative	0.0029	0.0156	0.0799
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0033	0.0338	0.0005
Echinococcus multilocularis	fk506 binding protein	0.0065	0.1956	0.1575
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0058	0.1587	0.281
Trypanosoma brucei	peptidyl-prolyl cis-trans isomerase, putative	0.0065	0.1956	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0033	0.0338	0.0005
Echinococcus multilocularis	phosphatidylinositol 4 phosphate 3 kinase C2	0.008	0.2704	0.2358
Mycobacterium ulcerans	FK-506 binding protein, peptidyl-prolyl cis-trans isomerase	0.0065	0.1956	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0036	0.0479	0.032
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0043	0.0851	0.1157
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0122	0.4789	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0033	0.0338	0.0005
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0036	0.0479	0.032
Schistosoma mansoni	immunophilin	0.0065	0.1956	0.1575
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.0043	0.0851	0.4353
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.0693	0.0803
Echinococcus multilocularis	phosphatidylinositol 4,5 bisphosphate 3 kinase	0.0226	1	1
Onchocerca volvulus		0.0035	0.0453	0.5
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0036	0.0495	0.0356
Trichomonas vaginalis	fk506-binding protein, putative	0.0065	0.1956	0.3639
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0122	0.4789	1
Brugia malayi	FKBP-type peptidyl-prolyl cis-trans isomerase-59, BmFKBP59	0.0065	0.1956	0.1741
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.0122	0.4789	1
Echinococcus multilocularis	acetylcholinesterase	0.0208	0.9088	0.9044
Brugia malayi	FKBP-type peptidyl-prolyl cis-trans isomerase-12, BmFKBP-12	0.0065	0.1956	0.1741
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0226	1	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0047	0.1032	0.1562
Plasmodium vivax	70 kDa peptidylprolyl isomerase, putative	0.0065	0.1956	0.5
Entamoeba histolytica	peptidyl-prolyl cis-trans isomerase, FKBP-type, putative	0.0065	0.1956	0.2806
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0058	0.1587	0.281
Toxoplasma gondii	target of rapamycin (TOR), putative	0.0044	0.0892	0.5
Echinococcus granulosus	acetylcholinesterase	0.0208	0.9088	0.9044
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0122	0.4789	1
Schistosoma mansoni	ataxia telangiectasia mutated (atm)-related	0.0058	0.1587	0.1188
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0047	0.1032	0.1562
Entamoeba histolytica	phosphatidylinositol 3-kinase 1, putative	0.0115	0.4438	0.911
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0098	0.358	0.6931
Trypanosoma cruzi	FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative	0.0065	0.1956	0.3394
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0036	0.0495	0.0356
Echinococcus multilocularis	peptidyl prolyl cis trans isomerase FKBP4	0.0065	0.1956	0.1575
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0043	0.0851	0.0462
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit gamma, putative	0.0122	0.4789	1
Onchocerca volvulus		0.0035	0.0453	0.5
Schistosoma mansoni	immunophilin	0.0056	0.1508	0.1105
Echinococcus granulosus	acetylcholinesterase	0.0208	0.9088	0.9044
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	0.0058	0.1587	0.8114
Trichomonas vaginalis	peptidylprolyl isomerase, putative	0.0065	0.1956	0.3639
Echinococcus granulosus	peptidyl prolyl cis trans isomerase FKBP1A	0.0065	0.1956	0.1575
Echinococcus granulosus	FKBP12 rapamycin complex associated protein	0.0058	0.1587	0.1188
Loa Loa (eye worm)	hypothetical protein	0.0208	0.9088	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0058	0.1587	0.281
Trichomonas vaginalis	peptidylprolyl isomerase, putative	0.0065	0.1956	0.3639
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0044	0.0892	0.1248
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0058	0.1587	0.1314
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0056	0.1496	0.1637
Giardia lamblia	FKBP-type peptidyl-prolyl cis-trans isomerase	0.0065	0.1956	1
Giardia lamblia	Phosphoinositide-3-kinase, catalytic, alpha polypeptide	0.0061	0.1728	0.8655
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0044	0.0892	0.1248
Trypanosoma cruzi	target of rapamycin kinase 3	0.0047	0.1034	0.1243
Loa Loa (eye worm)	carboxylesterase	0.0208	0.9088	1
Brugia malayi	Carboxylesterase family protein	0.0208	0.9088	1
Trichomonas vaginalis	immunophilin, putative	0.0065	0.1956	0.3639
Onchocerca volvulus		0.0035	0.0453	0.5
Echinococcus granulosus	phosphatidylinositol 4 phosphate 3 kinase C2	0.008	0.2704	0.2358
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0047	0.1032	0.1562
Echinococcus granulosus	carboxylesterase 5A	0.0208	0.9088	0.9044
Leishmania major	peptidylprolyl isomerase-like protein	0.0065	0.1956	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0044	0.0892	0.1248
Onchocerca volvulus		0.0035	0.0453	0.5
Loa Loa (eye worm)	phosphatidylinositol 3	0.0058	0.1587	0.1314
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0044	0.0892	0.1248
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0039	0.0635	0.0671
Echinococcus multilocularis	peptidyl prolyl cis trans isomerase FKBP4	0.0056	0.1508	0.1105
Schistosoma mansoni	immunophilin FK506 binding protein FKBP12	0.0065	0.1956	0.1575
Echinococcus multilocularis	FKBP12 rapamycin complex associated protein	0.0058	0.1587	0.1188
Plasmodium falciparum	peptidyl-prolyl cis-trans isomerase FKBP35	0.0065	0.1956	0.5
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0035	0.0453	0.5
Treponema pallidum	peptidyl-prolyl cis-trans isomerase, FKBP-type, 22 kDa (fklB)	0.0065	0.1956	0.5
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0047	0.1032	0.1562
Echinococcus granulosus	peptidyl prolyl cis trans isomerase FKBP4	0.0056	0.1508	0.1105
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0044	0.0892	0.1248
Schistosoma mansoni	immunophilin	0.0065	0.1956	0.1575
Trypanosoma cruzi	FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative	0.0065	0.1956	0.3394

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.149 uM	Inhibition of mTOR (unknown origin) by HTR-FRET substrate phosphorylation assay	ChEMBL.	26083478
IC50 (binding)	= 7.6 uM	Inhibition of PI3K-alpha (unknown origin) by mobility shift assay	ChEMBL.	26083478

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: CHEMBL3586396

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1936783