TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 197.236 | Formula: C12H11N3
H donors: 2 H acceptors: 1 LogP: 2.44 Rotable bonds: 1
Rule of 5 violations (Lipinski): 1
SMILES: Cc1[nH]nc(c1)c1cc2c([nH]1)cccc2
InChi: 1S/C12H11N3/c1-8-6-12(15-14-8)11-7-9-4-2-3-5-10(9)13-11/h2-7,13H,1H3,(H,14,15)
InChiKey: YLKJJERCKRGNPB-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	aurora kinase B	Starlite/ChEMBL	References
Homo sapiens	aurora kinase A	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Loa Loa (eye worm)	AUR protein kinase	Get druggable targets OG5_127024	All targets in OG5_127024
Candida albicans	likely protein kinase similar to S. cerevisiae IPL1 (YPL209C) Aurora protein kinase involved in regulating kinetochore-microtubu	Get druggable targets OG5_127024	All targets in OG5_127024
Schistosoma japonicum	ko:K08850 aurora kinase, putative	Get druggable targets OG5_127024	All targets in OG5_127024
Entamoeba histolytica	protein kinase, putative	Get druggable targets OG5_127024	All targets in OG5_127024
Brugia malayi	serine/threonine kinase 12	Get druggable targets OG5_127024	All targets in OG5_127024
Loa Loa (eye worm)	AUR protein kinase	Get druggable targets OG5_127024	All targets in OG5_127024
Trypanosoma congolense	aurora B kinase	Get druggable targets OG5_127024	All targets in OG5_127024
Plasmodium vivax	serine/threonine protein kinase 6, putative	Get druggable targets OG5_127024	All targets in OG5_127024
Trypanosoma brucei	aurora B kinase	Get druggable targets OG5_127024	All targets in OG5_127024
Plasmodium yoelii	Protein kinase domain, putative	Get druggable targets OG5_127024	All targets in OG5_127024
Plasmodium knowlesi	serine/threonine protein kinase, putative	Get druggable targets OG5_127024	All targets in OG5_127024
Echinococcus granulosus	serine:threonine protein kinase 12 B	Get druggable targets OG5_127024	All targets in OG5_127024
Leishmania major	protein kinase, putative	Get druggable targets OG5_127024	All targets in OG5_127024
Schistosoma japonicum	Serine/threonine-protein kinase 12, putative	Get druggable targets OG5_127024	All targets in OG5_127024
Leishmania infantum	protein kinase, putative	Get druggable targets OG5_127024	All targets in OG5_127024
Leishmania mexicana	protein kinase, putative	Get druggable targets OG5_127024	All targets in OG5_127024
Trichomonas vaginalis	AGC family protein kinase	Get druggable targets OG5_127024	All targets in OG5_127024
Brugia malayi	serine/threonine protein kinase 6	Get druggable targets OG5_127024	All targets in OG5_127024
Candida albicans	likely protein kinase similar to S. cerevisiae IPL1 (YPL209C) Aurora protein kinase involved in regulating kinetochore-microtubu	Get druggable targets OG5_127024	All targets in OG5_127024
Echinococcus multilocularis	serine:threonine protein kinase 12 B	Get druggable targets OG5_127024	All targets in OG5_127024
Trichomonas vaginalis	AGC family protein kinase	Get druggable targets OG5_127024	All targets in OG5_127024
Schistosoma mansoni	serine/threonine protein kinase	Get druggable targets OG5_127024	All targets in OG5_127024
Entamoeba histolytica	protein kinase domain containing protein	Get druggable targets OG5_127024	All targets in OG5_127024
Plasmodium yoelii	putative protein kinase	Get druggable targets OG5_127024	All targets in OG5_127024
Schistosoma mansoni	protein kinase	Get druggable targets OG5_127024	All targets in OG5_127024
Plasmodium falciparum	serine/threonine protein kinase, putative	Get druggable targets OG5_127024	All targets in OG5_127024
Leishmania donovani	Aurora I-related kinase	Get druggable targets OG5_127024	All targets in OG5_127024
Entamoeba histolytica	serine/threonine- protein kinase 6, putative	Get druggable targets OG5_127024	All targets in OG5_127024
Entamoeba histolytica	protein kinase , putative	Get druggable targets OG5_127024	All targets in OG5_127024
Plasmodium berghei	serine/threonine protein kinase, putative	Get druggable targets OG5_127024	All targets in OG5_127024
Entamoeba histolytica	serine/threonine protein kinase 6, putative	Get druggable targets OG5_127024	All targets in OG5_127024
Cryptosporidium parvum	protein kinase, putative	Get druggable targets OG5_127024	All targets in OG5_127024
Cryptosporidium hominis	protein kinase (EC 2.7.1.-) p46XlEg22	Get druggable targets OG5_127024	All targets in OG5_127024
Giardia lamblia	Aurora kinase	Get druggable targets OG5_127024	All targets in OG5_127024
Entamoeba histolytica	serine/threonine- protein kinase 6 , putative	Get druggable targets OG5_127024	All targets in OG5_127024
Entamoeba histolytica	protein kinase, putative	Get druggable targets OG5_127024	All targets in OG5_127024
Echinococcus multilocularis	aurora kinase A	Get druggable targets OG5_127024	All targets in OG5_127024
Brugia malayi	serine/threonine-protein kinase 6	Get druggable targets OG5_127024	All targets in OG5_127024
Echinococcus granulosus	aurora kinase A	Get druggable targets OG5_127024	All targets in OG5_127024
Toxoplasma gondii	aurora kinase	Get druggable targets OG5_127024	All targets in OG5_127024
Trypanosoma cruzi	aurora B kinase, putative	Get druggable targets OG5_127024	All targets in OG5_127024
Trypanosoma brucei gambiense	protein kinase, putative	Get druggable targets OG5_127024	All targets in OG5_127024
Loa Loa (eye worm)	AUR protein kinase	Get druggable targets OG5_127024	All targets in OG5_127024
Trichomonas vaginalis	AGC family protein kinase	Get druggable targets OG5_127024	All targets in OG5_127024
Leishmania braziliensis	protein kinase, putative	Get druggable targets OG5_127024	All targets in OG5_127024
Trichomonas vaginalis	AGC family protein kinase	Get druggable targets OG5_127024	All targets in OG5_127024
Neospora caninum	hypothetical protein	Get druggable targets OG5_127024	All targets in OG5_127024

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Trypanosoma brucei	mitogen-activated protein kinase 5	aurora kinase B	303 aa	299 aa	22.1 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Plasmodium falciparum	serine/threonine protein kinase, putative	0.0136	0.2892	1
Echinococcus multilocularis	glucose 6 phosphate 1 dehydrogenase	0.0091	0.1859	0.5195
Trypanosoma cruzi	isocitrate dehydrogenase, putative	0.0015	0.0105	0.031
Echinococcus multilocularis	flap endonuclease 1	0.0026	0.0338	0.0944
Toxoplasma gondii	isocitrate dehydrogenase	0.0015	0.0105	0.0355
Entamoeba histolytica	serine/threonine- protein kinase 6, putative	0.0136	0.2892	1
Trichomonas vaginalis	aldo/keto reductase, putative	0.0031	0.0462	0.1589
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.0782	0.2186
Mycobacterium tuberculosis	Probable glucose-6-phosphate 1-dehydrogenase Zwf2 (G6PD)	0.0032	0.048	1
Leishmania major	prostaglandin f2-alpha synthase/D-arabinose dehydrogenase	0.0031	0.0462	0.1589
Trichomonas vaginalis	aldo-keto reductase, putative	0.0031	0.0462	0.1589
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0011	0.0003	0.0008
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0146	0.3115	0.3115
Trypanosoma cruzi	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0015	0.0105	0.031
Trichomonas vaginalis	AGC family protein kinase	0.0136	0.2892	1
Loa Loa (eye worm)	oxidoreductase	0.0031	0.0462	0.0462
Schistosoma mansoni	glucose-6-phosphate 1-dehydrogenase	0.0091	0.1859	0.5191
Mycobacterium ulcerans	glucose-6-phosphate 1-dehydrogenase	0.006	0.1127	0.476
Echinococcus multilocularis	multidrug resistance protein 1	0.0011	0.0003	0.0008
Echinococcus multilocularis	isocitrate dehydrogenase 2 (NADP+)	0.0015	0.0105	0.0294
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0046	0.0813	0.0811
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0045	0.0782	0.0782
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0031	0.0462	0.129
Echinococcus multilocularis	GPCR, family 2	0.0046	0.0813	0.2273
Echinococcus granulosus	aldo keto reductase	0.0031	0.0462	0.129
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0813	0.0813
Loa Loa (eye worm)	oxidoreductase	0.0031	0.0462	0.0462
Plasmodium falciparum	isocitrate dehydrogenase [NADP], mitochondrial	0.0015	0.0105	0.0355
Entamoeba histolytica	protein kinase domain containing protein	0.0136	0.2892	1
Onchocerca volvulus	TPPP family protein homolog	0.0359	0.802	0.802
Echinococcus granulosus	aurora kinase A	0.0136	0.2892	0.8081
Echinococcus granulosus	aldehyde reductase	0.0022	0.0255	0.0713
Echinococcus multilocularis	tubulin polymerization promoting protein family	0.0012	0.0016	0.0045
Schistosoma mansoni	NADP-specific isocitrate dehydrogenase	0.0015	0.0105	0.0287
Plasmodium vivax	glucose-6-phosphate 1-dehydrogenase, putative	0.01	0.2047	0.7076
Leishmania major	hypothetical protein, conserved	0.0012	0.0016	0.0047
Mycobacterium tuberculosis	Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP)	0.0015	0.0105	0.2147
Loa Loa (eye worm)	AUR protein kinase	0.0136	0.2892	0.2892
Schistosoma mansoni	hypothetical protein	0.01	0.2049	0.5724
Giardia lamblia	Aurora kinase	0.0136	0.2892	1
Brugia malayi	glucose-6-phosphate dehydrogenase	0.0091	0.1859	0.1857
Trichomonas vaginalis	aldo-keto reductase, putative	0.0031	0.0462	0.1589
Trichomonas vaginalis	AGC family protein kinase	0.0136	0.2892	1
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0046	0.0813	0.2273
Brugia malayi	latrophilin 2 splice variant baaae	0.01	0.2049	0.2047
Echinococcus granulosus	tubulin polymerization promoting protein family	0.0012	0.0016	0.0045
Loa Loa (eye worm)	hypothetical protein	0.01	0.2049	0.2049
Schistosoma mansoni	protein kinase	0.0136	0.2892	0.8079
Echinococcus granulosus	multidrug resistance protein 1	0.0011	0.0003	0.0008
Brugia malayi	oxidoreductase, aldo/keto reductase family protein	0.0031	0.0462	0.0459
Trichomonas vaginalis	aldo-keto reductase, putative	0.0031	0.0462	0.1589
Trichomonas vaginalis	aldo-keto reductase, putative	0.0031	0.0462	0.1589
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.0011	0.0003	0.0008
Mycobacterium ulcerans	glucose-6-phosphate 1-dehydrogenase	0.0091	0.1859	1
Brugia malayi	Isocitrate dehydrogenase	0.0015	0.0105	0.0103
Trichomonas vaginalis	aldo/keto reductase, putative	0.0031	0.0462	0.1589
Entamoeba histolytica	aldose reductase, putative	0.0031	0.0462	0.1589
Trichomonas vaginalis	glucosamine-6-phosphate isomerase, putative	0.01	0.2047	0.7076
Loa Loa (eye worm)	p25-alpha family protein	0.0359	0.802	0.802
Brugia malayi	Flap endonuclease-1	0.0026	0.0338	0.0335
Schistosoma mansoni	aldo-keto reductase	0.0031	0.0462	0.1284
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0031	0.0462	0.129
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0015	0.0105	0.0294
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0031	0.0462	0.129
Onchocerca volvulus		0.0031	0.0462	0.0459
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.0011	0.0003	0.0008
Trypanosoma cruzi	glucose-6-phosphate 1-dehydrogenase, putative	0.0091	0.1859	0.6409
Schistosoma mansoni	p25-alpha domain containing protein	0.0012	0.0016	0.0038
Entamoeba histolytica	aldose reductase, putative	0.0031	0.0462	0.1589
Toxoplasma gondii	aurora kinase	0.0136	0.2892	1
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0031	0.0462	0.129
Trypanosoma cruzi	Glucose-6-phosphate dehydrogenase, putative	0.0029	0.0427	0.143
Trypanosoma brucei	isocitrate dehydrogenase, putative	0.0015	0.0105	0.031
Treponema pallidum	glucose-6-phosphate 1-dehydrogenase	0.0091	0.1859	0.5
Echinococcus granulosus	multidrug resistance protein 1	0.0011	0.0003	0.0008
Echinococcus granulosus	GPCR family 2	0.0046	0.0813	0.2273
Trypanosoma brucei	flap endonuclease-1 (FEN-1), putative	0.0026	0.0338	0.1118
Toxoplasma gondii	glucose-6-phosphate 1-dehydrogenase	0.006	0.1127	0.3891
Trichomonas vaginalis	dihydrodiol dehydrogenase, putative	0.0031	0.0462	0.1589
Trichomonas vaginalis	dihydrodiol dehydrogenase, putative	0.0031	0.0462	0.1589
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0031	0.0462	0.129
Entamoeba histolytica	serine/threonine- protein kinase 6 , putative	0.0136	0.2892	1
Brugia malayi	isocitrate dehydrogenase	0.0015	0.0105	0.0103
Trichomonas vaginalis	aldo-keto reductase, putative	0.0031	0.0462	0.1589
Echinococcus granulosus	aldo keto reductase	0.0031	0.0462	0.129
Leishmania major	glucose-6-phosphate 1-dehydrogenase, putative	0.0091	0.1859	0.6426
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0031	0.0462	0.129
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0011	0.0003	0.0008
Echinococcus granulosus	flap endonuclease 1	0.0026	0.0338	0.0944
Loa Loa (eye worm)	hypothetical protein	0.0444	1	1
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0046	0.0813	0.2273
Leishmania major	hypothetical protein, conserved	0.0012	0.0016	0.0047
Leishmania major	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0015	0.0105	0.0355
Echinococcus granulosus	glucose 6 phosphate 1 dehydrogenase	0.0091	0.1859	0.5195
Trichomonas vaginalis	aldo-keto reductase, putative	0.0031	0.0462	0.1589
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0031	0.0462	0.129
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.0011	0.0003	0.0008
Echinococcus granulosus	NADP dependent isocitrate dehydrogenase	0.0015	0.0105	0.0294
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.0782	0.2186
Chlamydia trachomatis	glucose-6-phosphate 1-dehydrogenase	0.0091	0.1859	1
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.0011	0.0003	0.0008
Toxoplasma gondii	p25-alpha family protein	0.0012	0.0016	0.0047
Leishmania major	flap endonuclease-1 (FEN-1), putative	0.0026	0.0338	0.1159
Onchocerca volvulus		0.0031	0.0462	0.0459
Trypanosoma brucei	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0015	0.0105	0.031
Echinococcus granulosus	tubulin polymerization promoting protein family	0.0012	0.0016	0.0045
Echinococcus granulosus	tubulin polymerization promoting protein family	0.0012	0.0016	0.0045
Giardia lamblia	Aldose reductase	0.0031	0.0462	0.1549
Toxoplasma gondii	glucose-6-phosphate 1-dehydrogenase	0.01	0.2047	0.7076
Echinococcus granulosus	multidrug resistance protein 1	0.0011	0.0003	0.0008
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0031	0.0462	0.129
Brugia malayi	serine/threonine protein kinase 6	0.0136	0.2892	0.289
Trypanosoma cruzi	aldo/keto reductase, putative	0.0031	0.0462	0.1549
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0146	0.3115	0.3113
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0015	0.0105	0.0294
Toxoplasma gondii	hypothetical protein	0.0012	0.0016	0.0047
Loa Loa (eye worm)	AUR protein kinase	0.0136	0.2892	0.2892
Loa Loa (eye worm)	oxidoreductase	0.0031	0.0462	0.0462
Echinococcus granulosus	tubulin polymerization promoting protein family	0.0012	0.0016	0.0045
Onchocerca volvulus		0.0031	0.0462	0.0459
Echinococcus multilocularis	aldo keto reductase	0.0031	0.0462	0.129
Trichomonas vaginalis	aldo-keto reductase, putative	0.0031	0.0462	0.1589
Brugia malayi	oxidoreductase, aldo/keto reductase family protein	0.0031	0.0462	0.0459
Schistosoma mansoni	serine/threonine protein kinase	0.0136	0.2892	0.8079
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0146	0.3115	0.3113
Brugia malayi	serine/threonine kinase 12	0.0136	0.2892	0.289
Mycobacterium leprae	PROBABLE OXIDOREDUCTASE	0.0031	0.0462	1
Loa Loa (eye worm)	oxidoreductase	0.0031	0.0462	0.0462
Entamoeba histolytica	aldose reductase, putative	0.0031	0.0462	0.1589
Onchocerca volvulus		0.0031	0.0462	0.0459
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0046	0.0813	0.0813
Trichomonas vaginalis	aldo-keto reductase, putative	0.0031	0.0462	0.1589
Toxoplasma gondii	aldose reductase, putative	0.0031	0.0462	0.1589
Schistosoma mansoni	aldo-keto reductase	0.0031	0.0462	0.1284
Echinococcus multilocularis	tubulin polymerization promoting protein family	0.0012	0.0016	0.0045
Echinococcus multilocularis	aurora kinase A	0.0136	0.2892	0.8081
Onchocerca volvulus		0.0031	0.0462	0.0459
Trichomonas vaginalis	dihydrodiol dehydrogenase, putative	0.0031	0.0462	0.1589
Entamoeba histolytica	serine/threonine protein kinase 6, putative	0.0136	0.2892	1
Echinococcus multilocularis	geminin	0.0166	0.3578	1
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0031	0.0462	0.129
Echinococcus granulosus	serine:threonine protein kinase 12 B	0.0136	0.2892	0.8081
Echinococcus multilocularis	tubulin polymerization promoting protein family	0.0012	0.0016	0.0045
Leishmania major	protein kinase, putative	0.0136	0.2892	1
Brugia malayi	oxidoreductase, aldo/keto reductase family protein	0.0031	0.0462	0.0459
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0011	0.0003	0.0008
Entamoeba histolytica	protein kinase, putative	0.0136	0.2892	1
Entamoeba histolytica	protein kinase, putative	0.0136	0.2892	1
Schistosoma mansoni	flap endonuclease-1	0.0023	0.0281	0.0778
Echinococcus multilocularis	isocitrate dehydrogenase	0.0015	0.0105	0.0294
Giardia lamblia	Aldose reductase	0.0031	0.0462	0.1549
Toxoplasma gondii	flap structure-specific endonuclease 1, putative	0.0026	0.0338	0.1159
Plasmodium vivax	p25-alpha family protein, putative	0.0012	0.0016	0.0047
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0003	0.0003
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0782	0.218
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0031	0.0462	0.129
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0031	0.0462	0.129
Trypanosoma cruzi	flap endonuclease-1 (FEN-1), putative	0.0026	0.0338	0.1118
Echinococcus multilocularis	tubulin polymerization promoting protein family	0.0012	0.0016	0.0045
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0462	0.0462
Schistosoma mansoni	pol-related	0.0031	0.0462	0.1284
Trichomonas vaginalis	flap endonuclease-1, putative	0.0026	0.0338	0.1159
Echinococcus multilocularis	multidrug resistance protein 1	0.0011	0.0003	0.0008
Trypanosoma brucei	aldo-keto reductase, putative	0.0031	0.0462	0.1549
Loa Loa (eye worm)	glucose-6-phosphate dehydrogenase	0.0091	0.1859	0.1859
Loa Loa (eye worm)	AUR protein kinase	0.0136	0.2892	0.2892
Brugia malayi	Latrophilin receptor protein 2	0.0046	0.0813	0.0811
Loa Loa (eye worm)	hypothetical protein	0.0146	0.3115	0.3115
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0031	0.0462	0.129
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0011	0.0003	0.0008
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0782	0.218
Trypanosoma cruzi	aurora B kinase, putative	0.0136	0.2892	1
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0031	0.0462	0.129
Onchocerca volvulus		0.0031	0.0462	0.0459
Plasmodium vivax	serine/threonine protein kinase 6, putative	0.0136	0.2892	1
Toxoplasma gondii	isocitrate dehydrogenase	0.0015	0.0105	0.0355
Loa Loa (eye worm)	oxidoreductase	0.0031	0.0462	0.0462
Trichomonas vaginalis	aldo-keto reductase, putative	0.0031	0.0462	0.1589
Loa Loa (eye worm)	isocitrate dehydrogenase	0.0015	0.0105	0.0105
Entamoeba histolytica	Flap nuclease, putative	0.0026	0.0338	0.1159
Loa Loa (eye worm)	ATP-binding cassette sub-family B member 2	0.0011	0.0003	0.0003
Giardia lamblia	Flap structure-specific endonuclease	0.0026	0.0338	0.1118
Echinococcus multilocularis	aldehyde reductase	0.0022	0.0255	0.0713
Echinococcus multilocularis	aldo keto reductase	0.0031	0.0462	0.129
Trypanosoma brucei	glucose-6-phosphate 1-dehydrogenase	0.0091	0.1859	0.6409
Trichomonas vaginalis	glucosamine-6-phosphate isomerase, putative	0.01	0.2047	0.7076
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0031	0.0462	0.129
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0031	0.0462	0.129
Trichomonas vaginalis	6-phosphogluconolactonase, putative	0.01	0.2047	0.7076
Schistosoma mansoni	P25 alpha-related	0.0012	0.0016	0.0038
Brugia malayi	p25-alpha family protein	0.0359	0.802	0.802
Trypanosoma brucei	prostaglandin f synthase	0.0031	0.0462	0.1549
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0045	0.0782	0.078
Plasmodium vivax	isocitrate dehydrogenase [NADP], mitochondrial, putative	0.0015	0.0105	0.0355
Plasmodium falciparum	flap endonuclease 1	0.0026	0.0338	0.1159
Plasmodium vivax	flap endonuclease 1, putative	0.0026	0.0338	0.1159
Echinococcus multilocularis	aldo keto reductase	0.0031	0.0462	0.129
Trichomonas vaginalis	AGC family protein kinase	0.0136	0.2892	1
Leishmania major	prostaglandin f synthase, putative	0.0031	0.0462	0.1589
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0046	0.0813	0.2273
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0031	0.0462	0.129
Schistosoma mansoni	hypothetical protein	0.0046	0.0813	0.2267
Trypanosoma brucei	aurora B kinase	0.0136	0.2892	1
Trypanosoma cruzi	glucose-6-phosphate 1-dehydrogenase, putative	0.003	0.0448	0.15
Brugia malayi	oxidoreductase, aldo/keto reductase family protein	0.0031	0.0462	0.0459
Onchocerca volvulus		0.0444	1	1
Giardia lamblia	Glucose-6-phosphate 1-dehydrogenase	0.01	0.2047	0.7063
Trichomonas vaginalis	aldo/keto reductase, putative	0.0031	0.0462	0.1589
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.0782	0.2186
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.0782	0.2186
Schistosoma mansoni	hypothetical protein	0.0046	0.0813	0.2267
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0782	0.218
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0011	0.0003	0.0008
Schistosoma mansoni	hypothetical protein	0.0012	0.0016	0.0038
Trichomonas vaginalis	aldo-keto reductase, putative	0.0031	0.0462	0.1589
Trichomonas vaginalis	aldo-keto reductase, putative	0.0031	0.0462	0.1589
Trypanosoma cruzi	aldo-keto reductase	0.0031	0.0462	0.1549
Trichomonas vaginalis	aldo-keto reductase, putative	0.0031	0.0462	0.1589
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0046	0.0813	0.2273
Plasmodium falciparum	glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase	0.01	0.2047	0.7076
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0031	0.0462	0.129
Mycobacterium tuberculosis	Probable oxidoreductase	0.0031	0.0462	0.9609
Brugia malayi	serine/threonine-protein kinase 6	0.0136	0.2892	0.289
Entamoeba histolytica	protein kinase , putative	0.0136	0.2892	1
Echinococcus multilocularis	aldo keto reductase	0.0031	0.0462	0.129
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0015	0.0105	0.0294
Leishmania major	aldehyde reductase, putative,oxidoreductase, putative	0.0031	0.0462	0.1589
Echinococcus granulosus	aldo keto reductase	0.0031	0.0462	0.129
Trichomonas vaginalis	AGC family protein kinase	0.0136	0.2892	1
Loa Loa (eye worm)	multidrug resistance protein 3	0.0011	0.0003	0.0003
Schistosoma mansoni	hypothetical protein	0.0166	0.3578	1
Toxoplasma gondii	p25-alpha family protein	0.0012	0.0016	0.0047
Schistosoma mansoni	hypothetical protein	0.0046	0.0813	0.2267
Leishmania major	aldo-keto reductase-like protein	0.0031	0.0462	0.1589
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0031	0.0462	0.129
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0031	0.0462	0.129
Echinococcus multilocularis	serine:threonine protein kinase 12 B	0.0136	0.2892	0.8081
Echinococcus granulosus	geminin	0.0166	0.3578	1
Schistosoma mansoni	hypothetical protein	0.0046	0.0813	0.2267
Loa Loa (eye worm)	flap endonuclease-1	0.0026	0.0338	0.0338
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0031	0.0462	0.129
Plasmodium falciparum	p25-alpha family protein, putative	0.0012	0.0016	0.0047
Echinococcus granulosus	hypothetical protein	0.0031	0.0462	0.129
Schistosoma mansoni	hypothetical protein	0.0166	0.3578	1
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0003	0.0003

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.51 uM	Inhibition of Aurora B	ChEMBL.	18630890
IC50 (binding)	= 1.1 uM	Inhibition of Aurora A	ChEMBL.	18630890

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: CHEMBL454457

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 951767