TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 318.172 | Formula: C13H12BrN5
H donors: 3 H acceptors: 2 LogP: 2.41 Rotable bonds: 2
Rule of 5 violations (Lipinski): 1
SMILES: CNc1c(Br)cnc2c1nc([nH]2)c1ccc(cc1)N
InChi: 1S/C13H12BrN5/c1-16-10-9(14)6-17-13-11(10)18-12(19-13)7-2-4-8(15)5-3-7/h2-6H,15H2,1H3,(H2,16,17,18,19)
InChiKey: NZELJWLQMFWZDX-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	TANK-binding kinase 1	Starlite/ChEMBL	References
Homo sapiens	inhibitor of kappa light polypeptide gene enhancer in B-cells, kinase epsilon	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Onchocerca volvulus		Get druggable targets OG5_132247	All targets in OG5_132247
Brugia malayi	Protein kinase domain containing protein	Get druggable targets OG5_132247	All targets in OG5_132247
Loa Loa (eye worm)	IKK protein kinase	Get druggable targets OG5_132247	All targets in OG5_132247

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
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.0244	0.0519	0.0499
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0244	0.0519	0.0499
Schistosoma mansoni	ataxia telangiectasia mutated (atm)-related	0.3777	1	1
Schistosoma mansoni	phosphatidylinositol 4-kinase type-II	0.0244	0.0519	0.0519
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0244	0.0519	0.0499
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0244	0.0519	0.0499
Trypanosoma brucei	FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative	0.1569	0.4075	0.4062
Trichomonas vaginalis	conserved hypothetical protein	0.0796	0.2001	0.1984
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.1267	0.3264	0.325
Loa Loa (eye worm)	hypothetical protein	0.0552	0.1347	0.1347
Plasmodium vivax	phosphatidylinositol 4-kinase, putative	0.0244	0.0519	1
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0244	0.0519	0.0499
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0471	0.1128	0.1109
Loa Loa (eye worm)	phosphatidylinositol 3	0.1267	0.3264	0.3264
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3777	1	1
Leishmania major	phosphatidylinositol 3-kinase, putative	0.0244	0.0519	0.0499
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0244	0.0519	0.0499
Plasmodium vivax	hypothetical protein	0.0244	0.0519	1
Schistosoma mansoni	immunophilin	0.0058	0.0021	0.0021
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2809	0.7403	0.7397
Trypanosoma brucei	phosphatidylinositol kinase related protein, putative	0.0714	0.1782	0.1765
Mycobacterium leprae	conserved hypothetical protein	0.0244	0.0519	0.5
Brugia malayi	phosphatidylinositol 4-kinase, catalytic, alpha polypeptide	0.0244	0.0519	0.0499
Entamoeba histolytica	Phosphatidylinositol 3- and 4-kinase family	0.0714	0.1782	0.1765
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.0244	0.0519	0.0499
Treponema pallidum	peptidyl-prolyl cis-trans isomerase, FKBP-type, 22 kDa (fklB)	0.0058	0.0021	0.5
Echinococcus multilocularis	fk506 binding protein	0.0058	0.0021	0.0021
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit gamma, putative	0.0244	0.0519	0.0499
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0244	0.0519	0.0519
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.0073	0.0062	0.0041
Echinococcus granulosus	phosphatidylinositol 4 kinase alpha	0.0244	0.0519	0.0519
Loa Loa (eye worm)	phosphatidylinositol 3	0.3777	1	1
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0244	0.0519	0.0499
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2036	0.5329	0.5319
Leishmania major	hypothetical protein, conserved	0.0244	0.0519	0.0499
Loa Loa (eye worm)	hypothetical protein	0.0471	0.1128	0.1128
Entamoeba histolytica	phosphatidylinositol 4-kinase, putative	0.0244	0.0519	0.0499
Mycobacterium ulcerans	FK-506 binding protein, peptidyl-prolyl cis-trans isomerase	0.0058	0.0021	0.5
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2039	0.5338	0.5328
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3004	0.7926	0.7922
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0244	0.0519	0.0499
Echinococcus granulosus	phosphatidylinositol 45 bisphosphate 3 kinase	0.0244	0.0519	0.0519
Trypanosoma brucei	phosphatidylinositol 3-related kinase, putative	0.1267	0.3264	0.325
Entamoeba histolytica	hypothetical protein	0.0714	0.1782	0.1765
Echinococcus granulosus	Phosphatidylinositol 4 kinase type 2 beta	0.0244	0.0519	0.0519
Entamoeba histolytica	hypothetical protein	0.0244	0.0519	0.0499
Toxoplasma gondii	FATC domain-containing protein	0.0714	0.1782	0.1835
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.1267	0.3264	0.325
Schistosoma mansoni	phosphatidylinositol 4-kinase	0.0244	0.0519	0.0519
Trypanosoma cruzi	phosphatidylinositol 4-kinase, putative	0.0244	0.0519	0.0499
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0244	0.0519	0.0499
Loa Loa (eye worm)	hypothetical protein	0.0244	0.0519	0.0519
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3777	1	1
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor1	0.3777	1	1
Onchocerca volvulus		0.1112	0.285	1
Echinococcus multilocularis	peptidyl prolyl cis trans isomerase FKBP4	0.0058	0.0021	0.0021
Entamoeba histolytica	phosphatidylinositol3-kinaseTor2, putative	0.3777	1	1
Giardia lamblia	Phosphatidylinositol 4-kinase	0.0244	0.0519	0.0499
Loa Loa (eye worm)	hypothetical protein	0.0714	0.1782	0.1782
Echinococcus multilocularis	Phosphatidylinositol 4 kinase type 2 beta	0.0244	0.0519	0.0519
Trypanosoma cruzi	phosphatidylinositol 4-kinase, putative	0.0244	0.0519	0.0499
Echinococcus granulosus	phosphatidylinositol 4 kinase beta	0.0244	0.0519	0.0519
Loa Loa (eye worm)	hypothetical protein	0.0796	0.2001	0.2001
Echinococcus granulosus	peptidyl prolyl cis trans isomerase FKBP4	0.0058	0.0021	0.0021
Trypanosoma brucei	target of rapamycin kinase 3, putative	0.3007	0.7935	0.793
Echinococcus multilocularis	serine:threonine protein kinase SMG1	0.0714	0.1782	0.1782
Giardia lamblia	Phosphoinositide-3-kinase, catalytic, alpha polypeptide	0.0244	0.0519	0.0499
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2809	0.7403	0.7397
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2533	0.6663	0.6656
Echinococcus granulosus	Phosphatidylinositol 4 kinase type 2 beta	0.0244	0.0519	0.0519
Echinococcus multilocularis	serine protein kinase ATM	0.0714	0.1782	0.1782
Loa Loa (eye worm)	FKBP5 protein	0.0058	0.0021	0.0021
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2809	0.7403	0.7397
Entamoeba histolytica	phosphatidylinositol 3-kinase 3, putative	0.0244	0.0519	0.0499
Schistosoma mansoni	phosphatidylinositol 3-kinase class	0.0244	0.0519	0.0519
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0244	0.0519	0.0499
Schistosoma mansoni	hypothetical protein	0.0244	0.0519	0.0519
Giardia lamblia	Phosphoinositide-3-kinase, class 3	0.0244	0.0519	0.0499
Plasmodium falciparum	phosphatidylinositol 4-kinase	0.0244	0.0519	1
Trypanosoma cruzi	phosphatidylinositol kinase, putative	0.0244	0.0519	0.0499
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.3777	1	1
Trypanosoma brucei	phosphatidylinositol 3-kinase catalytic subunit, putative	0.0244	0.0519	0.0499
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2809	0.7403	0.7397
Schistosoma mansoni	ataxia telangiectasia mutated (atm)	0.0714	0.1782	0.1782
Echinococcus multilocularis	phosphatidylinositol 3 and 4 kinase	0.1267	0.3264	0.3264
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0244	0.0519	0.0499
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2257	0.5921	0.5912
Toxoplasma gondii	target of rapamycin (TOR), putative	0.2809	0.7403	1
Leishmania major	phosphatidylinositol kinase, putative	0.0244	0.0519	0.0499
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2036	0.5329	0.5319
Echinococcus granulosus	phosphatidylinositol 4 phosphate 3 kinase C2	0.0244	0.0519	0.0519
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0244	0.0519	0.0499
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2809	0.7403	0.7397
Loa Loa (eye worm)	FKBP-type peptidyl-prolyl cis-trans isomerase-12	0.0058	0.0021	0.0021
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3777	1	1
Trypanosoma cruzi	target of rapamycin kinase 3	0.3007	0.7935	0.793
Loa Loa (eye worm)	IKK protein kinase	0.1112	0.285	0.285
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0244	0.0519	0.0499
Echinococcus granulosus	PIK kinase FAT and Armadillo domain containing protein	0.0552	0.1347	0.1347
Loa Loa (eye worm)	hypothetical protein	0.0244	0.0519	0.0519
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0714	0.1782	0.1765
Plasmodium vivax	phosphatidylinositol 3- and 4-kinase, putative	0.0244	0.0519	1
Echinococcus multilocularis		0.0244	0.0519	0.0519
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0073	0.0062	0.0062
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0068	0.0049	0.0028
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1267	0.3264	0.325
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2257	0.5921	0.5912
Echinococcus granulosus	phosphatidylinositol 3 and 4 kinase	0.1267	0.3264	0.3264
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1267	0.3264	0.325
Loa Loa (eye worm)	phosphatidylinositol 3	0.0244	0.0519	0.0519
Entamoeba histolytica	protein kinase rad3, putative	0.0714	0.1782	0.1765
Echinococcus granulosus	FKBP12 rapamycin complex associated protein	0.3777	1	1
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0244	0.0519	0.0499
Loa Loa (eye worm)	phosphatidylinositol kinase	0.0244	0.0519	0.0519
Loa Loa (eye worm)	hypothetical protein	0.0064	0.0036	0.0036
Trichomonas vaginalis	phosphatidylinositol 4-kinase, putative	0.0244	0.0519	0.0499
Leishmania major	phosphatidylinositol 4-kinase, putative	0.0244	0.0519	0.0499
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1013	0.2585	0.2569
Schistosoma mansoni	voltage-gated potassium channel	0.008	0.008	0.008
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	0.3777	1	1
Plasmodium falciparum	phosphatidylinositol 3- and 4-kinase, putative	0.0244	0.0519	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1267	0.3264	0.325
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0244	0.0519	0.0499
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0244	0.0519	0.0499
Brugia malayi	FAT domain containing protein	0.0552	0.1347	0.1329
Leishmania major	phosphatidylinositol 3-kinase, putative	0.1267	0.3264	0.325
Leishmania major	target of rapamycin (TOR) kinase 2, putative	0.3777	1	1
Schistosoma mansoni	phosphatidylinositol 3-and 4-kinase	0.1267	0.3264	0.3264
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.0244	0.0519	0.0499
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3004	0.7926	0.7922
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0714	0.1782	0.1765
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0244	0.0519	0.0499
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1267	0.3264	0.325
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.0714	0.1782	0.1765
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0714	0.1782	0.1765
Giardia lamblia	Hypothetical protein	0.0244	0.0519	0.0499
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0244	0.0519	0.5
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2039	0.5338	0.5328
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0244	0.0519	0.0499
Schistosoma mansoni	voltage-gated potassium channel	0.008	0.008	0.008
Echinococcus multilocularis	phosphatidylinositol 4 kinase alpha	0.0244	0.0519	0.0519
Schistosoma mansoni	immunophilin FK506 binding protein FKBP12	0.0058	0.0021	0.0021
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2809	0.7403	0.7397
Entamoeba histolytica	FKBP-rapamycin associated protein (FRAP), putative	0.3777	1	1
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0714	0.1782	0.1765
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0244	0.0519	0.0499
Entamoeba histolytica	hypothetical protein	0.0244	0.0519	0.0499
Schistosoma mansoni	fkbp-rapamycin associated protein	0.0714	0.1782	0.1782
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.0244	0.0519	0.0499
Echinococcus multilocularis	phosphatidylinositol 4,5 bisphosphate 3 kinase	0.0244	0.0519	0.0519
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3004	0.7926	0.7922
Entamoeba histolytica	phosphatidylinositol-4,5-bisphosphate 3-kinase, putative	0.0244	0.0519	0.0499
Echinococcus granulosus	phosphatidylinositol 3 kinase catalytic subunit	0.0244	0.0519	0.0519
Plasmodium vivax	phosphatidylinositol 3-kinase, putative	0.0244	0.0519	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2257	0.5921	0.5912
Echinococcus multilocularis	PIK kinase, FAT and Armadillo domain containing protein	0.0552	0.1347	0.1347
Trichomonas vaginalis	conserved hypothetical protein	0.0552	0.1347	0.1329
Trypanosoma cruzi	phosphatidylinositol 4-kinase alpha, putative	0.0244	0.0519	0.0499
Echinococcus multilocularis	phosphatidylinositol 4 phosphate 3 kinase C2	0.0244	0.0519	0.0519
Leishmania major	target of rapamycin kinase (TOR) kinase 3	0.3007	0.7935	0.793
Loa Loa (eye worm)	phosphatidylinositol 3	0.0244	0.0519	0.0519
Echinococcus granulosus	peptidyl prolyl cis trans isomerase FKBP1A	0.0058	0.0021	0.0021
Schistosoma mansoni	phosphatidylinositol 4-kinase	0.0244	0.0519	0.0519
Entamoeba histolytica	hypothetical protein	0.0244	0.0519	0.0499
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2234	0.5861	0.5852
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2036	0.5329	0.5319
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0073	0.0062	0.0062
Trichomonas vaginalis	conserved hypothetical protein	0.0471	0.1128	0.1109
Echinococcus multilocularis	Zinc finger, PHD finger	0.0244	0.0519	0.0519
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0244	0.0519	0.0499
Trypanosoma brucei	phosphatidylinositol 3-kinase tor, putative	0.1786	0.4658	0.4647
Plasmodium falciparum	phosphatidylinositol 3-kinase	0.0244	0.0519	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3004	0.7926	0.7922
Echinococcus multilocularis	Phosphatidylinositol 4 kinase type 2 beta	0.0244	0.0519	0.0519
Trypanosoma cruzi	phosphatidylinositol 3-kinase vps34-like	0.0244	0.0519	0.0499
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0244	0.0519	0.0499
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0244	0.0519	0.0499
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor2	0.3777	1	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1267	0.3264	0.325
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0244	0.0519	0.0499
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3225	0.8518	0.8515
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0244	0.0519	0.0499
Trypanosoma cruzi	phosphatidylinositol 4-kinase alpha, putative	0.0244	0.0519	0.0499
Plasmodium vivax	hypothetical protein, conserved	0.0244	0.0519	1
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.1267	0.3264	0.325
Echinococcus granulosus	serine:threonine protein kinase SMG1	0.0714	0.1782	0.1782
Entamoeba histolytica	hypothetical protein	0.0244	0.0519	0.0499
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2039	0.5338	0.5328
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0244	0.0519	0.0499
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0714	0.1782	0.1765
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3004	0.7926	0.7922
Leishmania major	hypothetical protein, unknown function	0.0244	0.0519	0.0499
Echinococcus granulosus	DNA dependent protein kinase catalytic subunit	0.0244	0.0519	0.0519
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.0244	0.0519	0.0499
Loa Loa (eye worm)	hypothetical protein	0.077	0.1931	0.1931
Trypanosoma brucei	phosphatidylinositol 4-kinase alpha, putative	0.0244	0.0519	0.0499
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0714	0.1782	0.1765
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0471	0.1128	0.1109
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2809	0.7403	0.7397
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2039	0.5338	0.5328
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0244	0.0519	0.0499
Leishmania major	phosphatidylinositol 4-kinase alpha, putative	0.0244	0.0519	0.0499
Leishmania major	target of rapamycin (TOR) kinase 1, putative	0.3777	1	1
Loa Loa (eye worm)	phosphatidylinositol 3	0.0244	0.0519	0.0519
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0068	0.0049	0.0028
Leishmania major	phosphatidylinositol kinase related protein, putative	0.0244	0.0519	0.0499
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0244	0.0519	0.0519
Toxoplasma gondii	non-specific serine/threonine protein kinase	0.0796	0.2001	0.2153
Echinococcus multilocularis	DNA dependent protein kinase catalytic subunit	0.0244	0.0519	0.0519
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2452	0.6445	0.6437
Schistosoma mansoni	hypothetical protein	0.0552	0.1347	0.1347
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.0073	0.0062	0.0062
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.1267	0.3264	0.325
Loa Loa (eye worm)	phosphatidylinositol 3	0.0244	0.0519	0.0519
Brugia malayi	Protein kinase domain containing protein	0.1112	0.285	0.2834
Plasmodium vivax	phosphatidylinositol 4-kinase, putative	0.0244	0.0519	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2234	0.5861	0.5852
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0244	0.0519	0.0519
Schistosoma mansoni	immunophilin	0.0058	0.0021	0.0021
Echinococcus multilocularis	FKBP12 rapamycin complex associated protein	0.3777	1	1
Loa Loa (eye worm)	phosphatidylinositol 3	0.0244	0.0519	0.0519
Leishmania major	phosphatidylinositol 3-related kinase, putative	0.1267	0.3264	0.325
Loa Loa (eye worm)	phosphatidylinositol 4-kinase type 3 alpha isoform 1	0.0244	0.0519	0.0519
Giardia lamblia	GTOR	0.3777	1	1
Echinococcus granulosus	serine protein kinase ATM	0.0714	0.1782	0.1782

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.111 uM	Inhibition of recombinant TBK1 using 5FAM-AhxKRRAL(ps)VASLPGL as substrate by microfluidic mobility shift assay	ChEMBL.	22305584
IC50 (binding)	= 0.425 uM	Inhibition of Ikkepsilon using 5FAM-AKELDQGSLCTpSFVGTLQ-NH2 as substrate by microfluidic mobility shift assay	ChEMBL.	22305584

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: CHEMBL2011911

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1632777