TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 429.414 | Formula: C22H20N7OP
H donors: 2 H acceptors: 5 LogP: 2.66 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: CP(=O)(c1ccc(cc1)Nc1ncnc2c1ncn2/C=C/c1cccc2c1cn[nH]2)C
InChi: 1S/C22H20N7OP/c1-31(2,30)17-8-6-16(7-9-17)27-21-20-22(24-13-23-21)29(14-25-20)11-10-15-4-3-5-19-18(15)12-26-28-19/h3-14H,1-2H3,(H,26,28)(H,23,24,27)/b11-10+
InChiKey: IWGIXRMJMSKLGP-ZHACJKMWSA-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	ABL proto-oncogene 1, non-receptor tyrosine kinase	Starlite/ChEMBL	References
Homo sapiens	SRC proto-oncogene, non-receptor tyrosine kinase	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Echinococcus granulosus	tyrosine protein kinase Fyn	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus granulosus	tyrosine protein kinase HCK	Get druggable targets OG5_127750	All targets in OG5_127750
Schistosoma japonicum	Proto-oncogene tyrosine-protein kinase Yrk, putative	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus granulosus	tyrosine kinase	Get druggable targets OG5_127750	All targets in OG5_127750
Brugia malayi	SRC-1	Get druggable targets OG5_127750	All targets in OG5_127750
Schistosoma japonicum	ko:K05703 proto-oncogene tyrosine-protein kinase Fyn, putative	Get druggable targets OG5_127750	All targets in OG5_127750
Schistosoma mansoni	tyrosine kinase	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus multilocularis	tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase	Get druggable targets OG5_127750	All targets in OG5_127750
Loa Loa (eye worm)	SRC-1	Get druggable targets OG5_127750	All targets in OG5_127750
Brugia malayi	Tyrosine-protein kinase abl-1	Get druggable targets OG5_131234	All targets in OG5_131234
Echinococcus granulosus	tyrosine protein kinase Src64B	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus granulosus	tyrosine protein kinase Src42A	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus granulosus	tyrosine protein kinase ABL1	Get druggable targets OG5_131234	All targets in OG5_131234
Echinococcus granulosus	tyrosine kinase\|tyrosine protein kinase Fyn	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus multilocularis	tyrosine protein kinase Fyn	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus multilocularis	tyrosine protein kinase Srms	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus granulosus	tyrosine protein kinase Src42A	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus multilocularis	tyrosine protein kinase Blk	Get druggable targets OG5_127750	All targets in OG5_127750
Schistosoma japonicum	Proto-oncogene tyrosine-protein kinase FYN, putative	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus granulosus	tyrosine protein kinase Lyn	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus multilocularis	tyrosine protein kinase Fyn	Get druggable targets OG5_127750	All targets in OG5_127750
Schistosoma mansoni	tyrosine kinase	Get druggable targets OG5_127750	All targets in OG5_127750
Entamoeba histolytica	protein kinase, putative	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus multilocularis	tyrosine protein kinase Src42A	Get druggable targets OG5_127750	All targets in OG5_127750
Schistosoma mansoni	tyrosine kinase	Get druggable targets OG5_131234	All targets in OG5_131234
Schistosoma japonicum	Tyrosine-protein kinase transforming protein Abl, putative	Get druggable targets OG5_131234	All targets in OG5_131234
Echinococcus multilocularis	tyrosine protein kinase HCK	Get druggable targets OG5_127750	All targets in OG5_127750
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_131234	All targets in OG5_131234
Echinococcus multilocularis	tyrosine protein kinase lyn tyrosine protein kinase blk	Get druggable targets OG5_127750	All targets in OG5_127750
Loa Loa (eye worm)	TK protein kinase	Get druggable targets OG5_127750	All targets in OG5_127750
Schistosoma japonicum	expressed protein	Get druggable targets OG5_131234	All targets in OG5_131234
Echinococcus multilocularis	tyrosine protein kinase ABL1	Get druggable targets OG5_131234	All targets in OG5_131234
Echinococcus multilocularis	tyrosine protein kinase Src64B	Get druggable targets OG5_127750	All targets in OG5_127750
Loa Loa (eye worm)	TK protein kinase	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus multilocularis	tyrosine protein kinase Src42A	Get druggable targets OG5_127750	All targets in OG5_127750
Schistosoma japonicum	Proto-oncogene tyrosine-protein kinase ABL1, putative	Get druggable targets OG5_131234	All targets in OG5_131234
Echinococcus granulosus	tyrosine protein kinase Fyn	Get druggable targets OG5_127750	All targets in OG5_127750
Schistosoma japonicum	Tyrosine-protein kinase transforming protein Abl, putative	Get druggable targets OG5_131234	All targets in OG5_131234
Echinococcus granulosus	3'partial\|tyrosine protein kinase Fgr	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus multilocularis	tyrosine protein kinase Fyn	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus multilocularis	proto oncogene tyrosine protein kinase LCK	Get druggable targets OG5_127750	All targets in OG5_127750
Schistosoma japonicum	ko:K08892 fyn-related kinase, putative	Get druggable targets OG5_127750	All targets in OG5_127750
Schistosoma japonicum	expressed protein	Get druggable targets OG5_131234	All targets in OG5_131234
Echinococcus granulosus	proto oncogene tyrosine protein kinase LCK	Get druggable targets OG5_127750	All targets in OG5_127750
Loa Loa (eye worm)	TK/ABL protein kinase	Get druggable targets OG5_131234	All targets in OG5_131234
Schistosoma japonicum	Proto-oncogene tyrosine-protein kinase FYN, putative	Get druggable targets OG5_127750	All targets in OG5_127750
Brugia malayi	protein-tyrosine kinase	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus granulosus	tyrosine protein kinase Fyn	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus multilocularis	tyrosine protein kinase Fyn	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus granulosus	tyrosine protein kinase Blk	Get druggable targets OG5_127750	All targets in OG5_127750
Schistosoma japonicum	Proto-oncogene tyrosine-protein kinase FGR, putative	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus multilocularis	tyrosine protein kinase Abl	Get druggable targets OG5_131234	All targets in OG5_131234
Echinococcus multilocularis	tyrosine protein kinase Fgr	Get druggable targets OG5_127750	All targets in OG5_127750

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
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0475	0.0869	0.0852
Echinococcus multilocularis	tyrosine protein kinase Abl	0.0114	0.0153	0.0151
Trypanosoma brucei	FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative	0.0117	0.016	0.0103
Trichomonas vaginalis	PIKK family atypical protein kinase	0.4055	0.7958	0.7954
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0362	0.0643	0.0643
Trypanosoma brucei	phosphatidylinositol 3-kinase tor, putative	0.2397	0.4675	0.4645
Trichomonas vaginalis	AGC family protein kinase	0.0066	0.0057	0.0039
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2768	0.5409	0.5401
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0406	0.0732	0.0732
Schistosoma mansoni	phosphatidylinositol 4-kinase	0.0339	0.06	0.06
Loa Loa (eye worm)	AGC/AKT protein kinase	0.0066	0.0057	0.0055
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0982	0.1873	0.1866
Leishmania major	phosphatidylinositol 3-related kinase, putative	0.1749	0.3391	0.3284
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0067	0.0061	0.0059
Entamoeba histolytica	FKBP-rapamycin associated protein (FRAP), putative	0.5086	1	1
Entamoeba histolytica	hypothetical protein	0.0339	0.06	0.0598
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0406	0.0732	0.0716
Echinococcus multilocularis	Zinc finger, PHD finger	0.0362	0.0643	0.0642
Echinococcus granulosus	serine/threonine protein kinase	0.0045	0.0016	0.0015
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0982	0.1873	0.1858
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0339	0.06	0.0582
Onchocerca volvulus		0.0339	0.06	0.5
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.0067	0.006	0.0052
Schistosoma mansoni	hyperpolarization activated cyclic nucleotide-gated potassium channel	0.0046	0.0018	0.0018
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.1737	0.3367	0.3329
Loa Loa (eye worm)	SRC-1	0.0054	0.0034	0.0032
Trichomonas vaginalis	PIKK family atypical protein kinase	0.33	0.6464	0.6457
Echinococcus multilocularis	tyrosine protein kinase ABL1	0.026	0.0442	0.044
Plasmodium falciparum	phosphatidylinositol 3-kinase	0.0362	0.0643	1
Loa Loa (eye worm)	phosphatidylinositol 3	0.0339	0.06	0.0598
Trichomonas vaginalis	peptidylprolyl isomerase, putative	0.0117	0.016	0.0142
Plasmodium vivax	phosphatidylinositol 4-kinase, putative	0.0339	0.06	0.931
Brugia malayi	phosphatidylinositol 4-kinase, catalytic, alpha polypeptide	0.0362	0.0643	0.0627
Brugia malayi	Tyrosine-protein kinase abl-1	0.0114	0.0153	0.0135
Entamoeba histolytica	protein kinase 2, putative	0.0041	0.0008	0.0007
Echinococcus multilocularis	FKBP12 rapamycin complex associated protein	0.5086	1	1
Echinococcus granulosus	voltage gated potassium channel	0.0067	0.0061	0.0059
Leishmania major	target of rapamycin (TOR) kinase 2, putative	0.5086	1	1
Echinococcus granulosus	peptidyl prolyl cis trans isomerase FKBP4	0.0117	0.016	0.0158
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1749	0.3391	0.3379
Trypanosoma cruzi	phosphatidylinositol 3-kinase vps34-like	0.0406	0.0732	0.0725
Leishmania major	target of rapamycin (TOR) kinase 1, putative	0.5086	1	1
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.0406	0.0732	0.0679
Echinococcus multilocularis	Glutaredoxin protein 5	0.004	0.0007	0.0006
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0406	0.0732	0.0731
Echinococcus multilocularis	serine threonine protein kinase nrc serine threonine protein kinase gad	0.0041	0.0008	0.0007
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.1793	0.3479	0.3467
Trichomonas vaginalis	PIKK family atypical protein kinase	0.304	0.5949	0.5941
Schistosoma mansoni	voltage-gated potassium channel	0.0254	0.043	0.043
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	0.5086	1	1
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0054	0.0034	0.0032
Schistosoma mansoni	hypothetical protein	0.0339	0.06	0.06
Treponema pallidum	peptidyl-prolyl cis-trans isomerase, FKBP-type, 22 kDa (fklB)	0.0117	0.016	0.5
Loa Loa (eye worm)	hypothetical protein	0.0067	0.0061	0.0059
Echinococcus granulosus	3'partial\|tyrosine protein kinase Fgr	0.0054	0.0034	0.0032
Echinococcus granulosus	phosphatidylinositol 4 phosphate 3 kinase C2	0.0475	0.0869	0.0867
Echinococcus granulosus	phosphatidylinositol 3 and 4 kinase	0.1793	0.3479	0.3478
Trichomonas vaginalis	AGC family protein kinase	0.0066	0.0057	0.0039
Leishmania major	hypothetical protein, conserved	0.0441	0.0801	0.0652
Plasmodium falciparum	peptidyl-prolyl cis-trans isomerase FKBP35	0.0117	0.016	0.2388
Schistosoma mansoni	phosphatidylinositol 3-and 4-kinase	0.1793	0.3479	0.3479
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0362	0.0643	0.0804
Echinococcus granulosus	peptidyl prolyl cis trans isomerase FKBP4	0.0101	0.0128	0.0126
Trichomonas vaginalis	PIKK family atypical protein kinase	0.4055	0.7958	0.7954
Echinococcus multilocularis	Phosphatidylinositol 4 kinase type 2 beta	0.0339	0.06	0.0598
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1737	0.3367	0.3355
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0508	0.0933	0.0932
Brugia malayi	Tyrosine-protein kinase abl-1	0.0154	0.0232	0.0215
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0362	0.0643	0.0626
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0339	0.06	0.0745
Brugia malayi	Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog	0.0067	0.0061	0.0043
Echinococcus granulosus	Phosphatidylinositol 4 kinase type 2 beta	0.0339	0.06	0.0598
Trichomonas vaginalis	PIKK family atypical protein kinase	0.4055	0.7958	0.7954
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0982	0.1873	0.1858
Trypanosoma brucei	phosphatidylinositol 3-kinase catalytic subunit, putative	0.0339	0.06	0.0546
Echinococcus granulosus	serine:threonine protein kinase SMG1	0.0982	0.1873	0.1872
Loa Loa (eye worm)	TK protein kinase	0.0046	0.0018	0.0016
Trypanosoma brucei	target of rapamycin kinase 3, putative	0.4059	0.7966	0.7955
Echinococcus granulosus	sodium:potassium dependent atpase beta subunit	0.004	0.0007	0.0006
Loa Loa (eye worm)	hypothetical protein	0.0098	0.0121	0.0119
Trichomonas vaginalis	phosphatidylinositol 4-kinase, putative	0.0362	0.0643	0.0626
Echinococcus multilocularis	proto oncogene tyrosine protein kinase LCK	0.0054	0.0034	0.0032
Echinococcus granulosus	Phosphatidylinositol 4 kinase type 2 beta	0.0339	0.06	0.0598
Schistosoma mansoni	tyrosine kinase	0.0251	0.0425	0.0425
Trichomonas vaginalis	AGC family protein kinase	0.0066	0.0057	0.0039
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor1	0.5086	1	1
Echinococcus multilocularis	sodium:potassium dependent atpase beta subunit	0.004	0.0007	0.0006
Giardia lamblia	FKBP-type peptidyl-prolyl cis-trans isomerase	0.0117	0.016	0.0152
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0045	0.0016	0.0015
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0994	0.1897	0.1882
Trypanosoma cruzi	phosphatidylinositol 4-kinase, putative	0.0339	0.06	0.0592
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0339	0.06	0.0582
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0553	0.1022	0.1006
Echinococcus granulosus	PIK kinase FAT and Armadillo domain containing protein	0.0754	0.1422	0.142
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0339	0.06	0.0583
Echinococcus multilocularis	tyrosine protein kinase Blk	0.0046	0.0018	0.0016
Trichomonas vaginalis	conserved hypothetical protein	0.1094	0.2094	0.2079
Entamoeba histolytica	protein kinase, putative	0.0066	0.0057	0.0055
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0232	0.0387	0.0386
Echinococcus granulosus	Glutaredoxin protein 5	0.004	0.0007	0.0006
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3412	0.6685	0.6679
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3795	0.7443	0.7438
Plasmodium falciparum	phosphatidylinositol 4-kinase	0.0339	0.06	0.931
Brugia malayi	FAT domain containing protein	0.0754	0.1422	0.1406
Entamoeba histolytica	hypothetical protein	0.0339	0.06	0.0598
Entamoeba histolytica	hypothetical protein	0.0339	0.06	0.0598
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3795	0.7443	0.7438
Echinococcus multilocularis	tyrosine protein kinase Fgr	0.0054	0.0034	0.0032
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0339	0.06	0.0583
Trypanosoma cruzi	rac serine-threonine kinase, putative	0.0045	0.0016	0.0008
Trypanosoma cruzi	phosphatidylinositol 4-kinase alpha, putative	0.0362	0.0643	0.0636
Loa Loa (eye worm)	phosphatidylinositol 4-kinase type 3 alpha isoform 1	0.0362	0.0643	0.0642
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3795	0.7443	0.7438
Leishmania major	hypothetical protein, unknown function	0.0339	0.06	0.0447
Plasmodium vivax	hypothetical protein, conserved	0.0339	0.06	0.931
Echinococcus multilocularis	voltage gated potassium channel	0.0067	0.0061	0.0059
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3795	0.7443	0.7438
Toxoplasma gondii	non-specific serine/threonine protein kinase	0.1094	0.2094	0.2765
Echinococcus granulosus	FKBP12 rapamycin complex associated protein	0.5086	1	1
Plasmodium vivax	70 kDa peptidylprolyl isomerase, putative	0.0117	0.016	0.2388
Entamoeba histolytica	peptidyl-prolyl cis-trans isomerase, FKBP-type , putative	0.0117	0.016	0.0158
Schistosoma mansoni	phosphatidylinositol 4-kinase type-II	0.0339	0.06	0.06
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0553	0.1022	0.1014
Schistosoma mansoni	immunophilin FK506 binding protein FKBP12	0.0117	0.016	0.016
Plasmodium vivax	phosphatidylinositol 3- and 4-kinase, putative	0.0339	0.06	0.931
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0553	0.1022	0.1005
Echinococcus multilocularis	peptidyl prolyl cis trans isomerase FKBP4	0.0101	0.0128	0.0126
Echinococcus multilocularis	cyclic nucleotide gated cation channel alpha 3	0.0046	0.0018	0.0017
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase, putative	0.0117	0.016	0.0152
Echinococcus granulosus	tyrosine protein kinase Fyn	0.0054	0.0034	0.0032
Plasmodium vivax	hypothetical protein	0.0339	0.06	0.931
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0018	0.0017
Trichomonas vaginalis	conserved hypothetical protein	0.0754	0.1422	0.1406
Entamoeba histolytica	Phosphatidylinositol 3- and 4-kinase family	0.0994	0.1897	0.1896
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0484	0.0886	0.0869
Giardia lamblia	70 kDa peptidylprolyl isomerase, putative	0.0117	0.016	0.0152
Echinococcus multilocularis	hyperpolarization activated cyclic	0.0046	0.0018	0.0017
Schistosoma mansoni	tyrosine kinase	0.0054	0.0034	0.0034
Trypanosoma cruzi	FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative	0.0117	0.016	0.0152
Trichomonas vaginalis	AGC family protein kinase	0.0066	0.0057	0.0039
Giardia lamblia	Phosphatidylinositol 4-kinase	0.0339	0.06	0.0592
Loa Loa (eye worm)	FKBP-type peptidyl-prolyl cis-trans isomerase-12	0.0117	0.016	0.0158
Entamoeba histolytica	phosphatidylinositol 4-kinase, putative	0.0362	0.0643	0.0642
Echinococcus multilocularis	DNA dependent protein kinase catalytic subunit	0.0627	0.1169	0.1167
Echinococcus granulosus	hyperpolarization activated cyclic	0.0046	0.0018	0.0017
Echinococcus multilocularis	rac serine:threonine kinase	0.0045	0.0016	0.0015
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3795	0.7443	0.7438
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0982	0.1873	0.1858
Brugia malayi	FKBP-type peptidyl-prolyl cis-trans isomerase-59, BmFKBP59	0.0117	0.016	0.0142
Giardia lamblia	Phosphoinositide-3-kinase, catalytic, alpha polypeptide	0.0439	0.0797	0.0789
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0217	0.0357	0.0339
Echinococcus multilocularis	phosphatidylinositol 4 phosphate 3 kinase C2	0.0475	0.0869	0.0867
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.0982	0.1873	0.1866
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2768	0.5409	0.5401
Trichomonas vaginalis	PIKK family atypical protein kinase	0.4055	0.7958	0.7954
Echinococcus granulosus	tyrosine protein kinase Src64B	0.0054	0.0034	0.0032
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0339	0.06	0.0583
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.0232	0.0387	0.037
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0339	0.06	0.0592
Echinococcus multilocularis	potassium:sodium hyperpolarization activated	0.0046	0.0018	0.0017
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0339	0.06	0.0582
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2764	0.5401	0.5392
Echinococcus multilocularis	tyrosine protein kinase Srms	0.0046	0.0018	0.0016
Trypanosoma brucei	phosphatidylinositol 3-related kinase, putative	0.1749	0.3391	0.3353
Echinococcus granulosus	serine protein kinase ATM	0.0982	0.1873	0.1872
Schistosoma mansoni	hyperpolarization activated cyclic nucleotide-gated potassium channel	0.0046	0.0018	0.0018
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0046	0.0018	0.0018
Loa Loa (eye worm)	phosphatidylinositol 3	0.0339	0.06	0.0598
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.0553	0.1022	0.1005
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0339	0.06	0.5
Schistosoma mansoni	phosphatidylinositol 4-kinase	0.0362	0.0643	0.0643
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0362	0.0643	0.0804
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0339	0.06	0.0745
Trichomonas vaginalis	fk506-binding protein, putative	0.0117	0.016	0.0142
Echinococcus multilocularis	nervana 2	0.004	0.0007	0.0006
Trichomonas vaginalis	PIKK family atypical protein kinase	0.4331	0.8506	0.8503
Plasmodium vivax	phosphatidylinositol 3-kinase, putative	0.0362	0.0643	1
Loa Loa (eye worm)	phosphatidylinositol 3	0.1749	0.3391	0.339
Loa Loa (eye worm)	phosphatidylinositol 3	0.5086	1	1
Leishmania major	phosphatidylinositol 3-kinase, putative	0.0362	0.0643	0.0491
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0339	0.06	0.0745
Trichomonas vaginalis	PIKK family atypical protein kinase	0.4055	0.7958	0.7954
Leishmania major	phosphatidylinositol 4-kinase alpha, putative	0.0362	0.0643	0.0491
Echinococcus multilocularis	PIK kinase, FAT and Armadillo domain containing protein	0.0754	0.1422	0.142
Echinococcus granulosus	calcium:calmodulin dependent protein kinase	0.0041	0.0008	0.0007
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0045	0.0016	0.0015
Toxoplasma gondii	target of rapamycin (TOR), putative	0.3795	0.7443	1
Trichomonas vaginalis	conserved hypothetical protein	0.0643	0.1201	0.1185
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2768	0.5409	0.5401
Echinococcus granulosus	tyrosine protein kinase Src42A	0.0054	0.0034	0.0032
Schistosoma mansoni	ataxia telangiectasia mutated (atm)	0.0982	0.1873	0.1873
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0484	0.0886	0.0869
Echinococcus granulosus	proto oncogene tyrosine protein kinase LCK	0.0054	0.0034	0.0032
Loa Loa (eye worm)	TK/ABL protein kinase	0.026	0.0442	0.044
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0746	0.1405	0.1405
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0643	0.1201	0.1194
Loa Loa (eye worm)	hypothetical protein	0.1027	0.1961	0.196
Echinococcus multilocularis	fk506 binding protein	0.0117	0.016	0.0158
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0046	0.0018	0.0018
Entamoeba histolytica	phosphatidylinositol 3-kinase 1, putative	0.0213	0.035	0.0348
Trichomonas vaginalis	AGC family protein kinase	0.0066	0.0057	0.0039
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3028	0.5925	0.5917
Schistosoma mansoni	tyrosine kinase	0.0054	0.0034	0.0034
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1366	0.2633	0.262
Giardia lamblia	Phosphoinositide-3-kinase, class 3	0.0384	0.0689	0.0681
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0054	0.0034	0.0032
Echinococcus multilocularis	nervana 2	0.004	0.0007	0.0006
Echinococcus granulosus	tyrosine protein kinase Lyn	0.0054	0.0035	0.0033
Schistosoma mansoni	fkbp-rapamycin associated protein	0.0982	0.1873	0.1873
Trichomonas vaginalis	AGC family protein kinase	0.0066	0.0057	0.0039
Echinococcus granulosus	tyrosine kinase\|tyrosine protein kinase Fyn	0.0046	0.0018	0.0016
Loa Loa (eye worm)	hypothetical protein	0.0982	0.1873	0.1872
Schistosoma mansoni	immunophilin	0.0117	0.016	0.016
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1737	0.3367	0.3355
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.1793	0.3479	0.3474
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase, putative	0.0117	0.016	0.0152
Loa Loa (eye worm)	hypothetical protein	0.1094	0.2094	0.2093
Schistosoma mansoni	voltage-gated potassium channel	0.0046	0.0018	0.0018
Loa Loa (eye worm)	phosphatidylinositol 3	0.0067	0.006	0.0058
Echinococcus multilocularis		0.0339	0.06	0.0598
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.043	0.078	0.0778
Schistosoma mansoni	voltage-gated potassium channel	0.0254	0.043	0.043
Schistosoma mansoni	voltage-gated potassium channel	0.0067	0.0061	0.0061
Echinococcus multilocularis	peptidyl prolyl cis trans isomerase FKBP4	0.0117	0.016	0.0158
Trypanosoma brucei	peptidyl-prolyl cis-trans isomerase, putative	0.0117	0.016	0.0103
Brugia malayi	SRC-1	0.0054	0.0034	0.0016
Loa Loa (eye worm)	hypothetical protein	0.0754	0.1422	0.142
Echinococcus multilocularis	Phosphatidylinositol 4 kinase type 2 beta	0.0339	0.06	0.0598
Loa Loa (eye worm)	AGC/RSK/P70 protein kinase	0.0061	0.0049	0.0047
Trypanosoma brucei	phosphatidylinositol kinase related protein, putative	0.0982	0.1873	0.1826
Echinococcus granulosus	cyclic nucleotide gated cation channel alpha 3	0.0046	0.0018	0.0017
Echinococcus multilocularis	phosphatidylinositol 3 and 4 kinase	0.1793	0.3479	0.3478
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.0339	0.06	0.0546
Toxoplasma gondii	FATC domain-containing protein	0.0982	0.1873	0.2467
Mycobacterium ulcerans	FK-506 binding protein, peptidyl-prolyl cis-trans isomerase	0.0117	0.016	0.5
Giardia lamblia	GTOR	0.5086	1	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.5086	1	1
Leishmania major	phosphatidylinositol kinase related protein, putative	0.0339	0.06	0.0447
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0054	0.0034	0.0032
Entamoeba histolytica	peptidyl-prolyl cis-trans isomerase, FKBP-type, putative	0.0117	0.016	0.0158
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3795	0.7443	0.7438
Brugia malayi	Cyclic-nucleotide gated cation channel	0.0046	0.0018	0.0001
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2768	0.5409	0.5401
Echinococcus granulosus	DNA dependent protein kinase catalytic subunit	0.0627	0.1169	0.1167
Echinococcus multilocularis	serine:threonine protein kinase SMG1	0.0982	0.1873	0.1872
Plasmodium vivax	phosphatidylinositol 4-kinase, putative	0.0339	0.06	0.931
Schistosoma mansoni	immunophilin	0.0117	0.016	0.016
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0067	0.0061	0.0059
Brugia malayi	FKBP-type peptidyl-prolyl cis-trans isomerase-12, BmFKBP-12	0.0117	0.016	0.0142
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit gamma, putative	0.0553	0.1022	0.1005
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0406	0.0732	0.0731
Schistosoma mansoni	phosphatidylinositol 3-kinase class	0.0339	0.06	0.06
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0553	0.1022	0.1014
Echinococcus granulosus	tyrosine protein kinase Fyn	0.0054	0.0034	0.0032
Trypanosoma cruzi	Protein kinase B	0.0045	0.0016	0.0008
Echinococcus multilocularis	phosphatidylinositol 4,5 bisphosphate 3 kinase	0.0746	0.1405	0.1404
Entamoeba histolytica	phosphatidylinositol-4,5-bisphosphate 3-kinase, putative	0.0362	0.0643	0.0642
Schistosoma mansoni	hypothetical protein	0.0754	0.1422	0.1422
Trichomonas vaginalis	PIKK family atypical protein kinase	0.304	0.5949	0.5941
Trichomonas vaginalis	peptidylprolyl isomerase, putative	0.0117	0.016	0.0142
Loa Loa (eye worm)	hypothetical protein	0.0643	0.1201	0.1199
Entamoeba histolytica	hypothetical protein	0.0508	0.0933	0.0932
Trypanosoma cruzi	phosphatidylinositol 4-kinase, putative	0.0339	0.06	0.0592
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2764	0.5401	0.5392
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3028	0.5925	0.5917
Loa Loa (eye worm)	phosphatidylinositol 3	0.0339	0.06	0.0598
Loa Loa (eye worm)	FKBP5 protein	0.0117	0.016	0.0158
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0406	0.0732	0.0715
Brugia malayi	p70 ribosomal S6 kinase beta	0.0061	0.0049	0.0031
Entamoeba histolytica	phosphatidylinositol3-kinaseTor2, putative	0.5086	1	1
Echinococcus granulosus	tyrosine protein kinase Src42A	0.0043	0.0013	0.0012
Loa Loa (eye worm)	hypothetical protein	0.0475	0.0869	0.0867
Entamoeba histolytica	phosphatidylinositol 3-kinase 3, putative	0.0339	0.06	0.0598
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0406	0.0732	0.0715
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.0339	0.06	0.0582
Trypanosoma cruzi	hypothetical protein, conserved	0.0102	0.0129	0.0121
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0046	0.0018	0.0016
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0046	0.0018	0.0018
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.5086	1	1
Echinococcus multilocularis	tyrosine protein kinase Src42A	0.0043	0.0013	0.0012
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.0232	0.0387	0.0386
Entamoeba histolytica	protein kinase rad3, putative	0.0982	0.1873	0.1872
Loa Loa (eye worm)	hypothetical protein	0.0077	0.0081	0.0079
Schistosoma mansoni	serine/threonine-protein kinase	0.0045	0.0016	0.0016
Schistosoma mansoni	immunophilin	0.0101	0.0128	0.0128
Trypanosoma cruzi	phosphatidylinositol kinase, putative	0.0339	0.06	0.0592
Trypanosoma cruzi	target of rapamycin kinase 3	0.4059	0.7966	0.7965
Brugia malayi	phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative	0.0194	0.0311	0.0293
Echinococcus granulosus	nervana 2	0.004	0.0007	0.0006
Plasmodium falciparum	phosphatidylinositol 3- and 4-kinase, putative	0.0339	0.06	0.931
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3795	0.7443	0.7438
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.1793	0.3479	0.3474
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0362	0.0643	0.0626
Entamoeba histolytica	hypothetical protein	0.0982	0.1873	0.1872
Echinococcus multilocularis	hyperpolarization activated cyclic	0.0046	0.0018	0.0017
Schistosoma mansoni	ataxia telangiectasia mutated (atm)-related	0.5086	1	1
Echinococcus multilocularis	phosphatidylinositol 4 kinase alpha	0.0362	0.0643	0.0642
Loa Loa (eye worm)	hypothetical protein	0.0339	0.06	0.0598
Echinococcus multilocularis	cyclic nucleotide gated cation channel	0.0046	0.0018	0.0017
Echinococcus granulosus	potassium:sodium hyperpolarization activated	0.0046	0.0018	0.0017
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2764	0.5401	0.5392
Trichomonas vaginalis	PIKK family atypical protein kinase	0.304	0.5949	0.5941
Mycobacterium leprae	conserved hypothetical protein	0.0339	0.06	0.5
Leishmania major	target of rapamycin kinase (TOR) kinase 3	0.4059	0.7966	0.7933
Trichomonas vaginalis	immunophilin, putative	0.0117	0.016	0.0142
Loa Loa (eye worm)	hypothetical protein	0.0202	0.0327	0.0325
Echinococcus granulosus	tyrosine kinase	0.0046	0.0018	0.0016
Echinococcus granulosus	serine threonine protein kinase nrc	0.0041	0.0008	0.0007
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0982	0.1873	0.1858
Echinococcus granulosus	phosphatidylinositol 45 bisphosphate 3 kinase	0.0746	0.1405	0.1404
Schistosoma mansoni	serine/threonine-protein kinase	0.0045	0.0016	0.0016
Giardia lamblia	Hypothetical protein	0.0339	0.06	0.0592
Schistosoma mansoni	voltage-gated potassium channel	0.0067	0.0061	0.0061
Trypanosoma cruzi	phosphatidylinositol 4-kinase alpha, putative	0.0362	0.0643	0.0636
Trichomonas vaginalis	PIKK family atypical protein kinase	0.5086	1	1
Trichomonas vaginalis	AGC family protein kinase	0.0066	0.0057	0.0039
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0406	0.0732	0.0715
Loa Loa (eye worm)	hypothetical protein	0.0101	0.0128	0.0126
Echinococcus granulosus	phosphatidylinositol 3 kinase catalytic subunit	0.0362	0.0643	0.0642
Leishmania major	phosphatidylinositol 3-kinase, putative	0.1737	0.3367	0.3259
Trypanosoma brucei	FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative	0.2125	0.4136	0.4102
Onchocerca volvulus		0.0339	0.06	0.5
Loa Loa (eye worm)	phosphatidylinositol kinase	0.0339	0.06	0.0598
Echinococcus granulosus	hyperpolarization activated cyclic	0.0046	0.0018	0.0017
Trypanosoma cruzi	FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative	0.0117	0.016	0.0152
Echinococcus multilocularis	tyrosine protein kinase lyn tyrosine protein kinase blk	0.0054	0.0034	0.0032
Echinococcus multilocularis	tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase	0.0054	0.0034	0.0032
Loa Loa (eye worm)	cyclic-nucleotide gated cation channel	0.0046	0.0018	0.0017
Trypanosoma brucei	phosphatidylinositol 4-kinase alpha, putative	0.0362	0.0643	0.059
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor2	0.5086	1	1
Echinococcus multilocularis	tyrosine protein kinase Src42A	0.0054	0.0034	0.0032
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1737	0.3367	0.3355
Echinococcus granulosus	peptidyl prolyl cis trans isomerase FKBP1A	0.0117	0.016	0.0158
Loa Loa (eye worm)	phosphatidylinositol 3	0.0701	0.1316	0.1315
Loa Loa (eye worm)	cyclic-nucleotide gated cation channel	0.0046	0.0018	0.0017
Echinococcus granulosus	cyclic nucleotide gated cation channel	0.0046	0.0018	0.0017
Echinococcus granulosus	cyclic nucleotide gated cation channel	0.0046	0.0018	0.0017
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0232	0.0387	0.0386
Brugia malayi	Protein kinase domain containing protein	0.0066	0.0057	0.0039
Echinococcus granulosus	phosphatidylinositol 4 kinase alpha	0.0362	0.0643	0.0642
Echinococcus granulosus	nervana 2	0.004	0.0007	0.0006
Echinococcus granulosus	tyrosine protein kinase ABL1	0.026	0.0442	0.044
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0553	0.1022	0.102
Echinococcus granulosus	phosphatidylinositol 4 kinase beta	0.0339	0.06	0.0598
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0217	0.0357	0.0339
Echinococcus granulosus	tyrosine protein kinase Fyn	0.0054	0.0034	0.0032
Echinococcus granulosus	tyrosine protein kinase Blk	0.0046	0.0018	0.0016
Entamoeba histolytica	protein kinase, putative	0.0066	0.0057	0.0055
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0643	0.1201	0.1185
Loa Loa (eye worm)	phosphatidylinositol 3	0.0339	0.06	0.0598
Entamoeba histolytica	protein kinase, putative	0.0061	0.0049	0.0047
Trichomonas vaginalis	PIKK family atypical protein kinase	0.5086	1	1
Leishmania major	phosphatidylinositol 4-kinase, putative	0.0339	0.06	0.0447
Echinococcus multilocularis	serine protein kinase ATM	0.0982	0.1873	0.1872
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.0339	0.06	0.0592
Echinococcus multilocularis	tyrosine protein kinase Src64B	0.0054	0.0034	0.0032
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1737	0.3367	0.3355
Leishmania major	phosphatidylinositol kinase, putative	0.0339	0.06	0.0447

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 2.36 nM	Inhibition of Abl kinase	ChEMBL.	18691885
IC50 (binding)	= 17 nM	Inhibition of human Src kinase by TR-FRET assay	ChEMBL.	18691885
IC50 (functional)	= 355 nM	Cytotoxicity against human K562 cells transfected with wild-type Bcr-Abl	ChEMBL.	18691885

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	ChEMBL23	18691885

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: CHEMBL452563

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 951781