TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 280.281 | Formula: C15H12N4O2
H donors: 3 H acceptors: 2 LogP: 0.29 Rotable bonds: 2
Rule of 5 violations (Lipinski): 1
SMILES: OCc1cc2n[nH]c(=O)n2c2c1ccc(c2)c1ccc[nH]1
InChi: 1S/C15H12N4O2/c20-8-10-7-14-17-18-15(21)19(14)13-6-9(3-4-11(10)13)12-2-1-5-16-12/h1-7,16,20H,8H2,(H,18,21)
InChiKey: FEKDFTQZRBQDGS-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	kinase insert domain receptor	Starlite/ChEMBL	References
Homo sapiens	mitogen-activated protein kinase kinase kinase 7	Starlite/ChEMBL	References
Homo sapiens	Janus kinase 2	Starlite/ChEMBL	References
Homo sapiens	checkpoint kinase 1	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma mansoni	serine/threonine protein kinase	Get druggable targets OG5_130454	All targets in OG5_130454
Schistosoma japonicum	Serine/threonine-protein kinase Chk1, putative	Get druggable targets OG5_130454	All targets in OG5_130454
Echinococcus multilocularis	kinase protein	Get druggable targets OG5_132679	All targets in OG5_132679
Onchocerca volvulus		Get druggable targets OG5_130320	All targets in OG5_130320
Brugia malayi	Protein kinase domain containing protein	Get druggable targets OG5_132679	All targets in OG5_132679
Echinococcus multilocularis	kinase protein	Get druggable targets OG5_132679	All targets in OG5_132679
Echinococcus granulosus	3'partial\|mitogen activated protein kinase kinase kinase	Get druggable targets OG5_132679	All targets in OG5_132679
Echinococcus multilocularis	mitogen activated protein kinase kinase kinase	Get druggable targets OG5_132679	All targets in OG5_132679
Echinococcus multilocularis	mitogen activated protein kinase kinase kinase 7	Get druggable targets OG5_132679	All targets in OG5_132679
Echinococcus granulosus	5'partial\|3'partial\|mitogen activated protein kinase kinase kinase	Get druggable targets OG5_132679	All targets in OG5_132679
Loa Loa (eye worm)	TKL/MLK/TAK1 protein kinase	Get druggable targets OG5_132679	All targets in OG5_132679
Loa Loa (eye worm)	CAMK/CAMKL/CHK1 protein kinase	Get druggable targets OG5_130454	All targets in OG5_130454
Echinococcus multilocularis	mitogen activated protein kinase kinase kinase	Get druggable targets OG5_132679	All targets in OG5_132679
Echinococcus multilocularis	mitogen activated protein kinase kinase kinase	Get druggable targets OG5_132679	All targets in OG5_132679
Brugia malayi	Protein kinase domain containing protein	Get druggable targets OG5_130454	All targets in OG5_130454
Loa Loa (eye worm)	TK/KIN16 protein kinase	Get druggable targets OG5_130320	All targets in OG5_130320
Brugia malayi	Immunoglobulin I-set domain containing protein	Get druggable targets OG5_130320	All targets in OG5_130320
Onchocerca volvulus	Tyrosine kinase homolog	Get druggable targets OG5_130320	All targets in OG5_130320
Echinococcus granulosus	mitogen activated protein kinase kinase kinase	Get druggable targets OG5_132679	All targets in OG5_132679
Echinococcus multilocularis	mitogen activated protein kinase kinase kinase	Get druggable targets OG5_132679	All targets in OG5_132679

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
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.004	0.0473	0.0469
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.004	0.0473	0.0095
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.021	0.3231	0.3231
Echinococcus multilocularis	ribosomal protein s6 kinase beta 1	0.0012	0.0004	0.0004
Brugia malayi	Protein kinase domain containing protein	0.0012	0.0004	0.0004
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0407	0.6427	0.6426
Echinococcus multilocularis	rac serine:threonine kinase	0.0024	0.0206	0.0206
Entamoeba histolytica	hypothetical protein	0.004	0.0473	0.0473
Loa Loa (eye worm)	hypothetical protein	0.004	0.0473	0.0473
Echinococcus granulosus	phosphatidylinositol 3 kinase catalytic subunit	0.004	0.0473	0.0473
Echinococcus granulosus	protein kinase c iota type	0.0012	0.0004	0.0004
Entamoeba histolytica	FKBP-rapamycin associated protein (FRAP), putative	0.0627	1	1
Schistosoma mansoni	phosphatidylinositol 3-and 4-kinase	0.021	0.3231	0.3231
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.004	0.0473	0.0469
Echinococcus granulosus	calcium:calmodulin dependent protein kinase	0.0022	0.0172	0.0172
Echinococcus granulosus	FKBP12 rapamycin complex associated protein	0.0627	1	1
Echinococcus multilocularis	nervana 2	0.0021	0.0159	0.0159
Loa Loa (eye worm)	AGC/DMPK/GEK protein kinase	0.0012	0.0004	0.0004
Entamoeba histolytica	protein kinase 2, putative	0.0022	0.0172	0.0172
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0078	0.1085	0.0929
Echinococcus granulosus	roundabout 2	0.0018	0.0105	0.0105
Trypanosoma brucei	phosphatidylinositol 3-kinase tor, putative	0.0296	0.4632	0.4419
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.004	0.0473	0.0469
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0498	0.7916	0.7915
Giardia lamblia	Phosphoinositide-3-kinase, class 3	0.004	0.0473	0.0306
Leishmania major	target of rapamycin (TOR) kinase 2, putative	0.0627	1	1
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.004	0.0473	0.0179
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.004	0.0473	0.0469
Trypanosoma cruzi	phosphatidylinositol 4-kinase alpha, putative	0.004	0.0473	0.0306
Toxoplasma gondii	non-specific serine/threonine protein kinase	0.0132	0.1962	0.2293
Plasmodium vivax	phosphatidylinositol 4-kinase, putative	0.004	0.0473	1
Loa Loa (eye worm)	phosphatidylinositol 3	0.004	0.0473	0.0473
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0338	0.5315	0.5313
Loa Loa (eye worm)	AGC/PKN protein kinase	0.0012	0.0004	0.0004
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.021	0.3231	0.2963
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.004	0.0473	0.0306
Echinococcus granulosus	tyrosine protein kinase Lyn	0.0012	0.0013	0.0013
Echinococcus multilocularis	serine protein kinase ATM	0.0119	0.1742	0.1742
Echinococcus granulosus	serine:threonine protein kinase SMG1	0.0119	0.1742	0.1742
Plasmodium vivax	phosphatidylinositol 3-kinase, putative	0.004	0.0473	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0498	0.7916	0.7915
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0119	0.1742	0.1742
Plasmodium vivax	hypothetical protein	0.004	0.0473	1
Echinococcus multilocularis	Phosphatidylinositol 4 kinase type 2 beta	0.004	0.0473	0.0473
Trichomonas vaginalis	AGC family protein kinase	0.0035	0.0381	0.0378
Loa Loa (eye worm)	hypothetical protein	0.0092	0.1305	0.1305
Trichomonas vaginalis	AGC family protein kinase	0.0014	0.0038	0.0034
Trypanosoma brucei	phosphatidylinositol 4-kinase alpha, putative	0.004	0.0473	0.0095
Echinococcus granulosus	ribosomal protein S6 kinase alpha 3	0.0012	0.0004	0.0004
Echinococcus multilocularis	serine:threonine protein kinase 38	0.0012	0.0004	0.0004
Schistosoma mansoni	phosphatidylinositol 3-kinase class	0.004	0.0473	0.0473
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.004	0.0473	0.0306
Trypanosoma brucei	target of rapamycin kinase 3, putative	0.0499	0.7925	0.7842
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.004	0.0473	0.0469
Schistosoma mansoni	cell adhesion molecule	0.0015	0.0058	0.0058
Echinococcus multilocularis	protein kinase c epsilon type	0.0012	0.0004	0.0004
Echinococcus multilocularis	ribosomal protein S6 kinase alpha 3	0.0012	0.0004	0.0004
Entamoeba histolytica	hypothetical protein	0.004	0.0473	0.0473
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	0.0627	1	1
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0024	0.0206	0.0206
Trichomonas vaginalis	conserved hypothetical protein	0.0078	0.1085	0.1082
Echinococcus granulosus	Protein kinase C brain isozyme	0.0012	0.0004	0.0004
Giardia lamblia	Phosphatidylinositol 4-kinase	0.004	0.0473	0.0306
Giardia lamblia	Phosphoinositide-3-kinase, catalytic, alpha polypeptide	0.004	0.0473	0.0306
Entamoeba histolytica	phosphatidylinositol3-kinaseTor2, putative	0.0627	1	1
Entamoeba histolytica	phosphatidylinositol-4,5-bisphosphate 3-kinase, putative	0.004	0.0473	0.0473
Trichomonas vaginalis	PIKK family atypical protein kinase	0.021	0.3231	0.3229
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0374	0.5901	0.59
Trypanosoma brucei	phosphatidylinositol 3-related kinase, putative	0.021	0.3231	0.2963
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0498	0.7916	0.7915
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.004	0.0473	0.0469
Trichomonas vaginalis	PIKK family atypical protein kinase	0.021	0.3231	0.3229
Brugia malayi	Protein kinase domain containing protein	0.0012	0.0004	0.0004
Echinococcus multilocularis	phosphatidylinositol 3 and 4 kinase	0.021	0.3231	0.3231
Schistosoma mansoni	serine/threonine-protein kinase	0.0024	0.0206	0.0206
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.004	0.0473	0.0469
Echinococcus multilocularis	roundabout 2	0.0018	0.0105	0.0105
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.0473	0.0469
Schistosoma mansoni	phosphatidylinositol 4-kinase type-II	0.004	0.0473	0.0473
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0466	0.739	0.7389
Toxoplasma gondii	target of rapamycin (TOR), putative	0.0466	0.739	1
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.004	0.0473	0.0473
Echinococcus granulosus	neuroglian	0.0014	0.0045	0.0045
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0466	0.739	0.7389
Trypanosoma cruzi	phosphatidylinositol kinase, putative	0.004	0.0473	0.0306
Schistosoma mansoni	phosphatidylinositol 4-kinase	0.004	0.0473	0.0473
Schistosoma mansoni	serine/threonine protein kinase	0.0012	0.0004	0.0004
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.0473	0.0469
Echinococcus multilocularis	Zinc finger, PHD finger	0.004	0.0473	0.0473
Schistosoma mansoni	hypothetical protein	0.0092	0.1305	0.1305
Trypanosoma cruzi	rac serine-threonine kinase, putative	0.0024	0.0206	0.0035
Entamoeba histolytica	phosphatidylinositol 3-kinase 3, putative	0.004	0.0473	0.0473
Echinococcus multilocularis	mitogen activated protein kinase kinase kinase	0.0107	0.1558	0.1558
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.004	0.0473	0.0473
Echinococcus granulosus	twitchin	0.0015	0.0058	0.0058
Echinococcus multilocularis	sodium:potassium dependent atpase beta subunit	0.0021	0.0159	0.0159
Giardia lamblia	GTOR	0.0627	1	1
Schistosoma mansoni	serine/threonine protein kinase	0.0202	0.3104	0.3104
Trichomonas vaginalis	AGC family protein kinase	0.0035	0.0381	0.0378
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.004	0.0473	0.0179
Plasmodium falciparum	phosphatidylinositol 3- and 4-kinase, putative	0.004	0.0473	1
Echinococcus granulosus	PIK kinase FAT and Armadillo domain containing protein	0.0092	0.1305	0.1305
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0168	0.2548	0.2545
Loa Loa (eye worm)	CAMK/CAMKL/CHK1 protein kinase	0.0202	0.3104	0.3104
Entamoeba histolytica	protein kinase, putative	0.0012	0.0004	0.0004
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0119	0.1742	0.1742
Plasmodium vivax	phosphatidylinositol 4-kinase, putative	0.004	0.0473	1
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor1	0.0627	1	1
Trichomonas vaginalis	AGC family protein kinase	0.0035	0.0381	0.0378
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.004	0.0473	0.0306
Schistosoma mansoni	hypothetical protein	0.004	0.0473	0.0473
Trichomonas vaginalis	PIKK family atypical protein kinase	0.042	0.6647	0.6646
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0466	0.739	0.7389
Trypanosoma cruzi	phosphatidylinositol 3-kinase vps34-like	0.004	0.0473	0.0306
Entamoeba histolytica	hypothetical protein	0.0119	0.1742	0.1742
Echinococcus granulosus	Phosphatidylinositol 4 kinase type 2 beta	0.004	0.0473	0.0473
Echinococcus multilocularis		0.004	0.0473	0.0473
Echinococcus granulosus	serine threonine protein kinase nrc	0.0022	0.0172	0.0172
Mycobacterium leprae	conserved hypothetical protein	0.004	0.0473	0.5
Loa Loa (eye worm)	hypothetical protein	0.0119	0.1742	0.1742
Echinococcus multilocularis	mitogen activated protein kinase kinase kinase	0.0107	0.1558	0.1558
Echinococcus multilocularis	phosphatidylinositol 4 phosphate 3 kinase C2	0.004	0.0473	0.0473
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0466	0.739	0.7389
Toxoplasma gondii	FATC domain-containing protein	0.0119	0.1742	0.1981
Loa Loa (eye worm)	phosphatidylinositol 3	0.021	0.3231	0.3231
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0119	0.1742	0.1739
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.004	0.0473	0.0179
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0498	0.7916	0.7915
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.004	0.0473	0.0179
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0338	0.5307	0.5305
Loa Loa (eye worm)	AGC/RSK/RSK protein kinase	0.0012	0.0004	0.0004
Echinococcus granulosus	phosphatidylinositol 45 bisphosphate 3 kinase	0.004	0.0473	0.0473
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0338	0.5315	0.5313
Schistosoma mansoni	serine/threonine protein kinase	0.0012	0.0004	0.0004
Plasmodium vivax	hypothetical protein, conserved	0.004	0.0473	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0119	0.1742	0.1739
Onchocerca volvulus	Tyrosine kinase homolog	0.0175	0.2657	1
Trichomonas vaginalis	AGC family protein kinase	0.0035	0.0381	0.0378
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0078	0.1085	0.1082
Echinococcus granulosus	sodium:potassium dependent atpase beta subunit	0.0021	0.0159	0.0159
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.004	0.0473	0.0473
Echinococcus multilocularis	serine threonine protein kinase	0.0012	0.0004	0.0004
Echinococcus multilocularis	nervana 2	0.0021	0.0159	0.0159
Echinococcus granulosus	phosphatidylinositol 4 kinase alpha	0.004	0.0473	0.0473
Echinococcus granulosus	ribosomal protein s6 kinase beta 1	0.0012	0.0004	0.0004
Trichomonas vaginalis	AGC family protein kinase	0.0035	0.0381	0.0378
Echinococcus granulosus	protein kinase c epsilon type	0.0012	0.0004	0.0004
Entamoeba histolytica	protein kinase, putative	0.0035	0.0381	0.0381
Echinococcus multilocularis	protein kinase c iota type	0.0012	0.0004	0.0004
Brugia malayi	Protein kinase domain containing protein	0.0202	0.3104	0.3104
Schistosoma mansoni	serine/threonine protein kinase	0.0012	0.0004	0.0004
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0371	0.5841	0.5839
Schistosoma mansoni	atypical protein kinase C	0.0012	0.0004	0.0004
Echinococcus granulosus	phosphatidylinositol 4 kinase beta	0.004	0.0473	0.0473
Loa Loa (eye worm)	hypothetical protein	0.0078	0.1085	0.1085
Echinococcus granulosus	5'partial\|3'partial\|mitogen activated protein kinase kinase kinase	0.0107	0.1558	0.1558
Loa Loa (eye worm)	TK/KIN16 protein kinase	0.0187	0.2853	0.2853
Echinococcus multilocularis	Glutaredoxin protein 5	0.0021	0.0159	0.0159
Echinococcus multilocularis	mitogen activated protein kinase kinase kinase	0.0112	0.1631	0.1631
Loa Loa (eye worm)	hypothetical protein	0.0132	0.1962	0.1962
Loa Loa (eye worm)	AGC/PKC/ETA protein kinase	0.0012	0.0004	0.0004
Schistosoma mansoni	serine/threonine protein kinase	0.0012	0.0004	0.0004
Echinococcus multilocularis	serine:threonine protein kinase N2	0.0012	0.0004	0.0004
Onchocerca volvulus		0.004	0.0473	0.178
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0535	0.8511	0.851
Loa Loa (eye worm)	hypothetical protein	0.004	0.0473	0.0473
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit gamma, putative	0.004	0.0473	0.0469
Trichomonas vaginalis	AGC family protein kinase	0.0035	0.0381	0.0378
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.004	0.0473	0.0473
Onchocerca volvulus		0.004	0.0473	0.178
Leishmania major	target of rapamycin (TOR) kinase 1, putative	0.0627	1	1
Loa Loa (eye worm)	phosphatidylinositol 3	0.004	0.0473	0.0473
Trichomonas vaginalis	PIKK family atypical protein kinase	0.021	0.3231	0.3229
Brugia malayi	FAT domain containing protein	0.0092	0.1305	0.1305
Echinococcus granulosus	phosphatidylinositol 4 phosphate 3 kinase C2	0.004	0.0473	0.0473
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.004	0.0473	0.0469
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0338	0.5315	0.5313
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0466	0.739	0.7389
Echinococcus multilocularis	mitogen activated protein kinase kinase kinase 7	0.0107	0.1558	0.1558
Echinococcus granulosus	protein kinase C gamma type	0.0012	0.0004	0.0004
Onchocerca volvulus		0.0167	0.2525	0.9502
Plasmodium falciparum	phosphatidylinositol 4-kinase	0.004	0.0473	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0498	0.7916	0.7915
Entamoeba histolytica	Phosphatidylinositol 3- and 4-kinase family	0.0119	0.1742	0.1742
Loa Loa (eye worm)	phosphatidylinositol kinase	0.004	0.0473	0.0473
Echinococcus granulosus	3'partial\|mitogen activated protein kinase kinase kinase	0.0107	0.1558	0.1558
Echinococcus granulosus	nervana 2	0.0021	0.0159	0.0159
Loa Loa (eye worm)	phosphatidylinositol 3	0.004	0.0473	0.0473
Plasmodium falciparum	phosphatidylinositol 3-kinase	0.004	0.0473	1
Schistosoma mansoni	serine/threonine-protein kinase	0.0024	0.0206	0.0206
Schistosoma mansoni	nephrin	0.0014	0.0045	0.0045
Plasmodium vivax	phosphatidylinositol 3- and 4-kinase, putative	0.004	0.0473	1
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.0627	1	1
Echinococcus granulosus	Ribosomal protein S6 kinase beta 2	0.0012	0.0004	0.0004
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.004	0.0473	0.0473
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0024	0.0206	0.0206
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0466	0.739	0.7389
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0119	0.1742	0.1739
Echinococcus multilocularis	kinase protein	0.0107	0.1558	0.1558
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0338	0.5307	0.5305
Entamoeba histolytica	hypothetical protein	0.004	0.0473	0.0473
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0338	0.5315	0.5313
Trichomonas vaginalis	AGC family protein kinase	0.0035	0.0381	0.0378
Trichomonas vaginalis	conserved hypothetical protein	0.0092	0.1305	0.1302
Echinococcus multilocularis	kinase protein	0.0107	0.1558	0.1558
Giardia lamblia	Hypothetical protein	0.004	0.0473	0.0306
Trypanosoma cruzi	phosphatidylinositol 4-kinase, putative	0.004	0.0473	0.0306
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0371	0.5841	0.5839
Brugia malayi	Protein kinase domain containing protein	0.0035	0.0381	0.0381
Brugia malayi	Hr1 repeat family protein	0.0012	0.0004	0.0004
Echinococcus multilocularis	PIK kinase, FAT and Armadillo domain containing protein	0.0092	0.1305	0.1305
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0374	0.5901	0.59
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0119	0.1742	0.1598
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.004	0.0473	0.0469
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.0119	0.1742	0.1598
Echinococcus multilocularis	neuroglian	0.0014	0.0045	0.0045
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0187	0.2853	0.2853
Schistosoma mansoni	serine/threonine protein kinase	0.0012	0.0004	0.0004
Echinococcus granulosus	nervana 2	0.0021	0.0159	0.0159
Trypanosoma cruzi	Protein kinase B	0.0024	0.0206	0.0035
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.004	0.0473	0.0473
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.004	0.0473	0.0469
Echinococcus granulosus	DNA dependent protein kinase catalytic subunit	0.004	0.0473	0.0473
Schistosoma mansoni	ataxia telangiectasia mutated (atm)	0.0119	0.1742	0.1742
Echinococcus granulosus	Glutaredoxin protein 5	0.0021	0.0159	0.0159
Trichomonas vaginalis	PIKK family atypical protein kinase	0.021	0.3231	0.3229
Loa Loa (eye worm)	AGC/RSK/P70 protein kinase	0.0033	0.0347	0.0347
Leishmania major	phosphatidylinositol 3-kinase, putative	0.021	0.3231	0.2895
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.004	0.0473	0.0473
Trichomonas vaginalis	PIKK family atypical protein kinase	0.021	0.3231	0.3229
Echinococcus granulosus	serine protein kinase ATM	0.0119	0.1742	0.1742
Schistosoma mansoni	ataxia telangiectasia mutated (atm)-related	0.0627	1	1
Loa Loa (eye worm)	hypothetical protein	0.0128	0.1891	0.1891
Brugia malayi	p70 ribosomal S6 kinase beta	0.0033	0.0347	0.0347
Echinococcus multilocularis	serine:threonine protein kinase SMG1	0.0119	0.1742	0.1742
Echinococcus multilocularis	Ribosomal protein S6 kinase beta 2	0.0012	0.0004	0.0004
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.004	0.0473	0.0473
Schistosoma mansoni	serine/threonine protein kinase	0.0012	0.0004	0.0004
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0374	0.5901	0.59
Brugia malayi	phosphatidylinositol 4-kinase, catalytic, alpha polypeptide	0.004	0.0473	0.0473
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0338	0.5307	0.5305
Loa Loa (eye worm)	phosphatidylinositol 4-kinase type 3 alpha isoform 1	0.004	0.0473	0.0473
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0627	1	1
Echinococcus granulosus	Phosphatidylinositol 4 kinase type 2 beta	0.004	0.0473	0.0473
Echinococcus granulosus	phosphatidylinositol 3 and 4 kinase	0.021	0.3231	0.3231
Loa Loa (eye worm)	phosphatidylinositol 3	0.004	0.0473	0.0473
Schistosoma mansoni	fkbp-rapamycin associated protein	0.0119	0.1742	0.1742
Trichomonas vaginalis	conserved hypothetical protein	0.0132	0.1962	0.1959
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.004	0.0473	0.0473
Echinococcus granulosus	mitogen activated protein kinase kinase kinase	0.0112	0.1631	0.1631
Trypanosoma cruzi	target of rapamycin kinase 3	0.0499	0.7925	0.7888
Echinococcus multilocularis	serine threonine protein kinase nrc serine threonine protein kinase gad	0.0022	0.0172	0.0172
Entamoeba histolytica	protein kinase, putative	0.0035	0.0381	0.0381
Echinococcus multilocularis	FKBP12 rapamycin complex associated protein	0.0627	1	1
Trypanosoma brucei	phosphatidylinositol 3-kinase catalytic subunit, putative	0.004	0.0473	0.0095
Loa Loa (eye worm)	phosphatidylinositol 3	0.0627	1	1
Echinococcus multilocularis	serine:threonine protein kinase N2	0.0012	0.0004	0.0004
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.004	0.0473	0.0306
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0105	0.0105
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.004	0.0473	0.0469
Echinococcus multilocularis	phosphatidylinositol 4,5 bisphosphate 3 kinase	0.004	0.0473	0.0473
Mycobacterium tuberculosis	Conserved hypothetical protein	0.004	0.0473	0.5
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.004	0.0473	0.0473
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0466	0.739	0.7389
Trypanosoma brucei	phosphatidylinositol kinase related protein, putative	0.0119	0.1742	0.1415
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0058	0.0058
Echinococcus granulosus	neurotracting:lsamp:neurotrimin:obcam	0.0015	0.0058	0.0058
Leishmania major	target of rapamycin kinase (TOR) kinase 3	0.0499	0.7925	0.7822
Loa Loa (eye worm)	AGC/AKT protein kinase	0.0035	0.0381	0.0381
Schistosoma mansoni	phosphatidylinositol 4-kinase	0.004	0.0473	0.0473
Entamoeba histolytica	hypothetical protein	0.004	0.0473	0.0473
Echinococcus multilocularis	mitogen activated protein kinase kinase kinase	0.0107	0.1558	0.1558
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.004	0.0473	0.0095
Entamoeba histolytica	phosphatidylinositol 4-kinase, putative	0.004	0.0473	0.0473
Echinococcus multilocularis	Protein kinase C, brain isozyme	0.0012	0.0004	0.0004
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.004	0.0473	0.0473
Echinococcus multilocularis	Phosphatidylinositol 4 kinase type 2 beta	0.004	0.0473	0.0473
Loa Loa (eye worm)	AGC/NDR protein kinase	0.0012	0.0004	0.0004
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.004	0.0473	0.0473
Entamoeba histolytica	protein kinase rad3, putative	0.0119	0.1742	0.1742
Trypanosoma cruzi	phosphatidylinositol 4-kinase, putative	0.004	0.0473	0.0306
Schistosoma mansoni	serine/threonine protein kinase	0.0012	0.0004	0.0004
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.021	0.3231	0.3113
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.004	0.0473	0.0179
Schistosoma mansoni	serine/threonine kinase	0.0012	0.0004	0.0004
Brugia malayi	Protein kinase domain containing protein	0.0112	0.1631	0.1631
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0627	1	1
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.004	0.0473	0.0473
Loa Loa (eye worm)	AGC/RSK/MSK protein kinase	0.0012	0.0004	0.0004
Echinococcus multilocularis	DNA dependent protein kinase catalytic subunit	0.004	0.0473	0.0473
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.021	0.3231	0.3113
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0105	0.0105
Trypanosoma brucei	FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative	0.026	0.4046	0.381
Trypanosoma cruzi	phosphatidylinositol 4-kinase alpha, putative	0.004	0.0473	0.0306
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor2	0.0627	1	1
Echinococcus granulosus	NDR protein kinase	0.0012	0.0004	0.0004
Brugia malayi	protein kinase C II.	0.0012	0.0004	0.0004
Trichomonas vaginalis	phosphatidylinositol 4-kinase, putative	0.004	0.0473	0.0469
Loa Loa (eye worm)	phosphatidylinositol 3	0.004	0.0473	0.0473
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0627	1	1
Echinococcus granulosus	serine/threonine protein kinase	0.0024	0.0206	0.0206
Schistosoma mansoni	tyrosine kinase	0.0012	0.0008	0.0008
Leishmania major	phosphatidylinositol 3-related kinase, putative	0.021	0.3231	0.2895
Echinococcus multilocularis	phosphatidylinositol 4 kinase alpha	0.004	0.0473	0.0473
Loa Loa (eye worm)	TKL/MLK/TAK1 protein kinase	0.0112	0.1631	0.1631
Entamoeba histolytica	protein kinase, putative	0.0033	0.0347	0.0347
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.004	0.0473	0.0473
Echinococcus granulosus	serine:threonine protein kinase N2	0.0012	0.0004	0.0004
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0004	0.0004

Activities

Activity type	Activity value	Assay description	Source	Reference
EC50 (functional)	= 0.24 uM	Inhibition of camptothecin-induced cell cycle arrest in human HT-29 cells assessed as abrogation at G2/M checkpoint measuring phosphohistone-H3 level treated with compound 2 hrs after camptothecin-challenge	ChEMBL.	22342147
Fu (ADMET)	< 1.6 %	Plasma protein binding in mouse assessed as free fraction	ChEMBL.	22342147
Fu (ADMET)	< 5.2 %	Plasma protein binding in human assessed as free fraction	ChEMBL.	22342147
IC50 (binding)	= 319 nM	Inhibition of KDR	ChEMBL.	22342147
IC50 (binding)	= 650 nM	Inhibition of JAK2	ChEMBL.	22342147
IC50 (binding)	= 650 nM	Inhibition of MAP3K7	ChEMBL.	22342147
IC50 (binding)	= 0.02 uM	Inhibition of Chk1	ChEMBL.	22342147

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	ChEMBL23	22342147

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: CHEMBL2012881

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1632762