TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 403.434 | Formula: C22H21N5O3
H donors: 2 H acceptors: 3 LogP: 3.26 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: COCC(=O)Nc1cccc(c1)c1nc(Nc2ccc(cc2)OC)c2n(c1)ccn2
InChi: 1S/C22H21N5O3/c1-29-14-20(28)24-17-5-3-4-15(12-17)19-13-27-11-10-23-22(27)21(26-19)25-16-6-8-18(30-2)9-7-16/h3-13H,14H2,1-2H3,(H,24,28)(H,25,26)
InChiKey: UAVIDYPAYSLILU-UHFFFAOYSA-N

Network

Hover on a compound node to display the structore

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

This is a work in progress. Come back soon to try this features!

Clustering layers

This is a work in progress. Come back soon to try this features!

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
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
Echinococcus granulosus	serine:threonine protein kinase 12 B	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
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 japonicum	Serine/threonine-protein kinase 12, putative	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
Plasmodium berghei	serine/threonine 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
Schistosoma mansoni	serine/threonine 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
Neospora caninum	hypothetical protein	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
Trichomonas vaginalis	AGC family protein kinase	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
Trichomonas vaginalis	AGC family protein kinase	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
Echinococcus multilocularis	serine:threonine protein kinase 12 B	Get druggable targets OG5_127024	All targets in OG5_127024
Giardia lamblia	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
Entamoeba histolytica	protein kinase, putative	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
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
Trypanosoma brucei	aurora B kinase	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
Brugia malayi	serine/threonine kinase 12	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	aurora kinase A	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
Toxoplasma gondii	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
Schistosoma mansoni	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
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
Loa Loa (eye worm)	AUR protein 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
Leishmania infantum	protein 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
Plasmodium falciparum	serine/threonine protein kinase, putative	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
Leishmania donovani	Aurora I-related kinase	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
Leishmania mexicana	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
Brugia malayi	serine/threonine-protein kinase 6	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

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Trypanosoma cruzi	quinonoid dihydropteridine reductase, putative	0.1276	1	1
Echinococcus granulosus	3 ketodihydrosphingosine reductase	0.0059	0.0266	0.028
Mycobacterium tuberculosis	Possible iron-regulated short-chain dehydrogenase/reductase	0.0059	0.0266	0.5
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0059	0.0266	0.5
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.0059	0.0266	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0059	0.0266	0.5
Mycobacterium tuberculosis	Possible fatty acyl-CoA reductase	0.0059	0.0266	0.5
Entamoeba histolytica	serine/threonine protein kinase 6, putative	0.0068	0.0339	1
Entamoeba histolytica	protein kinase, putative	0.0068	0.0339	1
Mycobacterium tuberculosis	Possible short-chain dehydrogenase EphD	0.0059	0.0266	0.5
Mycobacterium ulcerans	3-alpha-hydroxysteroid dehydrogenase	0.0059	0.0266	0.5
Schistosoma mansoni	dihydropteridine reductase	0.1217	0.9528	1
Echinococcus granulosus	carbonyl reductase 1	0.0059	0.0266	0.028
Echinococcus multilocularis	retinol dehydrogenase 11	0.0059	0.0266	0.028
Mycobacterium ulcerans	carveol-like dehydrogenase	0.0059	0.0266	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0059	0.0266	0.5
Mycobacterium ulcerans	ketoacyl reductase	0.0059	0.0266	0.5
Leishmania major	quinonoid dihydropteridine reductase	0.1276	1	1
Echinococcus multilocularis	conserved hypothetical protein	0.0059	0.0266	0.028
Toxoplasma gondii	6,7-dihydropteridine reductase	0.1217	0.9528	1
Mycobacterium tuberculosis	Probable oxidoreductase	0.0059	0.0266	0.5
Echinococcus multilocularis	aurora kinase A	0.0068	0.0339	0.0356
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0059	0.0266	0.5
Mycobacterium tuberculosis	Probable oxidoreductase	0.0059	0.0266	0.5
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0059	0.0266	0.5
Giardia lamblia	Aurora kinase	0.0068	0.0339	1
Loa Loa (eye worm)	hypothetical protein	0.0357	0.2649	0.2572
Mycobacterium tuberculosis	Probable dehydrogenase/reductase	0.0059	0.0266	0.5
Trypanosoma cruzi	aurora B kinase, putative	0.0068	0.0339	0.0075
Echinococcus multilocularis	transient receptor potential cation channel	0.0059	0.0266	0.028
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.0059	0.0266	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0059	0.0266	0.5
Mycobacterium tuberculosis	Possible oxidoreductase	0.0059	0.0266	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0059	0.0266	0.5
Leishmania major	quinonoid dihydropteridine reductase	0.1276	1	1
Echinococcus multilocularis	retinol dehydrogenase 11	0.0059	0.0266	0.028
Onchocerca volvulus		0.0059	0.0266	0.5
Mycobacterium ulcerans	3-ketoacyl-ACP reductase	0.0059	0.0266	0.5
Echinococcus multilocularis	3 ketodihydrosphingosine reductase	0.0059	0.0266	0.028
Echinococcus multilocularis	serine:threonine protein kinase 12 B	0.0068	0.0339	0.0356
Mycobacterium tuberculosis	Probable short chain alcohol dehydrogenase/reductase	0.0059	0.0266	0.5
Mycobacterium tuberculosis	Probable shortchain dehydrogenase	0.0059	0.0266	0.5
Trichomonas vaginalis	AGC family protein kinase	0.0068	0.0339	1
Mycobacterium ulcerans	short chain dehydrogenase	0.0059	0.0266	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0059	0.0266	0.5
Onchocerca volvulus		0.0059	0.0266	0.5
Brugia malayi	dihydropteridine reductase-like	0.1217	0.9528	1
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.0059	0.0266	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0059	0.0266	0.5
Echinococcus granulosus	steroid dehydrogenase	0.0059	0.0266	0.028
Echinococcus granulosus	hypothetical protein	0.0059	0.0266	0.028
Mycobacterium ulcerans	short chain dehydrogenase	0.0059	0.0266	0.5
Leishmania major	protein kinase, putative	0.0068	0.0339	0.0075
Mycobacterium ulcerans	short chain dehydrogenase	0.0059	0.0266	0.5
Mycobacterium tuberculosis	Probable dehydrogenase	0.0059	0.0266	0.5
Echinococcus granulosus	3 hydroxyacyl coenzyme A dehydrogenase type 2	0.0059	0.0266	0.028
Onchocerca volvulus	Sepiapterin reductase homolog	0.0059	0.0266	0.5
Mycobacterium tuberculosis	Probable dehydrogenase/reductase	0.0059	0.0266	0.5
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0059	0.0266	0.5
Mycobacterium tuberculosis	Probable short-chain dehydrogenase/reductase	0.0059	0.0266	0.5
Echinococcus multilocularis	NAD(P) binding domain	0.1217	0.9528	1
Echinococcus granulosus	retinol dehydrogenase 11	0.0059	0.0266	0.028
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0059	0.0266	0.5
Echinococcus multilocularis	3 hydroxyacyl coenzyme A dehydrogenase type 2	0.0059	0.0266	0.028
Echinococcus granulosus	carbonyl reductase 1	0.0059	0.0266	0.028
Echinococcus granulosus	carbonyl reductase 1	0.0059	0.0266	0.028
Toxoplasma gondii	aurora kinase	0.0068	0.0339	0.0079
Mycobacterium ulcerans	short chain dehydrogenase	0.0059	0.0266	0.5
Trypanosoma cruzi	C-8 sterol isomerase, putative	0.0357	0.2649	0.2448
Mycobacterium ulcerans	short-chain dehydrogenase	0.0059	0.0266	0.5
Mycobacterium leprae	Possible short-chain dehydrogenase EphD	0.0059	0.0266	0.5
Schistosoma mansoni	protein kinase	0.0068	0.0339	0.0079
Mycobacterium ulcerans	short chain dehydrogenase	0.0059	0.0266	0.5
Echinococcus multilocularis	epidermal retinal dehydrogenase 2	0.0059	0.0266	0.028
Mycobacterium ulcerans	oxidoreductase	0.0059	0.0266	0.5
Loa Loa (eye worm)	dihydropteridine reductase-PC	0.1217	0.9528	1
Onchocerca volvulus		0.0059	0.0266	0.5
Mycobacterium leprae	Probable short-chain type dehydrogenase/reductase	0.0059	0.0266	0.5
Entamoeba histolytica	protein kinase, putative	0.0068	0.0339	1
Echinococcus multilocularis	carbonyl reductase 1	0.0059	0.0266	0.028
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0059	0.0266	0.5
Echinococcus multilocularis	retinol dehydrogenase 13	0.0059	0.0266	0.028
Onchocerca volvulus	Dehydrogenase\/reductase SDR family member 13 homolog	0.0059	0.0266	0.5
Onchocerca volvulus		0.0059	0.0266	0.5
Trypanosoma brucei	aurora B kinase	0.0068	0.0339	0.0305
Mycobacterium ulcerans	short chain dehydrogenase	0.0059	0.0266	0.5
Mycobacterium tuberculosis	Probable oxidoreductase	0.0059	0.0266	0.5
Echinococcus granulosus	epidermal retinal dehydrogenase 2	0.0059	0.0266	0.028
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.0059	0.0266	0.5
Echinococcus granulosus	NADP binding domain	0.1217	0.9528	1
Echinococcus granulosus	carbonyl reductase 1	0.0059	0.0266	0.028
Schistosoma mansoni	serine/threonine protein kinase	0.0068	0.0339	0.0079
Echinococcus granulosus	aurora kinase A	0.0068	0.0339	0.0356
Loa Loa (eye worm)	AUR protein kinase	0.0068	0.0339	0.0079
Leishmania major	quinonoid dihydropteridine reductase	0.1276	1	1
Onchocerca volvulus		0.0059	0.0266	0.5
Onchocerca volvulus		0.0059	0.0266	0.5
Leishmania major	quinonoid dihydropteridine reductase	0.1276	1	1
Mycobacterium tuberculosis	Possible ketoacyl reductase	0.0059	0.0266	0.5
Wolbachia endosymbiont of Brugia malayi	Short-chain alcohol dehydrogenase family enzyme	0.0059	0.0266	0.5
Echinococcus granulosus	hypothetical protein	0.0059	0.0266	0.028
Mycobacterium ulcerans	short chain dehydrogenase	0.0059	0.0266	0.5
Trypanosoma brucei	C-8 sterol isomerase, putative	0.0357	0.2649	1
Loa Loa (eye worm)	hypothetical protein	0.0182	0.1253	0.1066
Echinococcus multilocularis	steroid dehydrogenase	0.0059	0.0266	0.028
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.0059	0.0266	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0059	0.0266	0.5
Mycobacterium tuberculosis	Probable oxidoreductase	0.0059	0.0266	0.5
Onchocerca volvulus		0.0059	0.0266	0.5
Brugia malayi	serine/threonine kinase 12	0.0068	0.0339	0.0079
Loa Loa (eye worm)	AUR protein kinase	0.0068	0.0339	0.0079
Echinococcus granulosus	WW domain containing oxidoreductase	0.0059	0.0266	0.028
Entamoeba histolytica	serine/threonine- protein kinase 6 , putative	0.0068	0.0339	1
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0059	0.0266	0.5
Mycobacterium ulcerans	dehydrogenase/decarboxylase protein	0.0059	0.0266	0.5
Mycobacterium tuberculosis	Probable short-chain type oxidoreductase	0.0059	0.0266	0.5
Leishmania major	quinonoid dihydropteridine reductase	0.1276	1	1
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.0059	0.0266	0.5
Leishmania major	quinonoid dihydropteridine reductase	0.1276	1	1
Brugia malayi	ERG2 and Sigma1 receptor like protein	0.0357	0.2649	0.2572
Mycobacterium tuberculosis	Possible multi-functional enzyme with acyl-CoA-reductase activity AcrA1	0.0059	0.0266	0.5
Onchocerca volvulus		0.0059	0.0266	0.5
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.0059	0.0266	0.5
Mycobacterium tuberculosis	Possible oxidoreductase	0.0059	0.0266	0.5
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0059	0.0266	0.5
Mycobacterium ulcerans	short-chain dehydrogenase	0.0059	0.0266	0.5
Mycobacterium ulcerans	short-chain type oxidoreductase	0.0059	0.0266	0.5
Mycobacterium leprae	PROBABLE SHORT CHAIN ALCOHOL DEHYDROGENASE/REDUCTASE	0.0059	0.0266	0.5
Onchocerca volvulus	Dehydrogenase\/reductase SDR family member 1 homolog	0.0059	0.0266	0.5
Brugia malayi	serine/threonine protein kinase 6	0.0068	0.0339	0.0079
Trichomonas vaginalis	AGC family protein kinase	0.0068	0.0339	1
Mycobacterium ulcerans	short-chain dehydrogenase	0.0059	0.0266	0.5
Mycobacterium ulcerans	short-chain dehydrogenase	0.0059	0.0266	0.5
Loa Loa (eye worm)	AUR protein kinase	0.0068	0.0339	0.0079
Mycobacterium ulcerans	short chain dehydrogenase	0.0059	0.0266	0.5
Onchocerca volvulus		0.0059	0.0266	0.5
Mycobacterium tuberculosis	Probable oxidoreductase	0.0059	0.0266	0.5
Mycobacterium ulcerans	ketoacyl reductase	0.0059	0.0266	0.5
Echinococcus multilocularis	carbonyl reductase 1	0.0059	0.0266	0.028
Mycobacterium leprae	ROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCTASE	0.0059	0.0266	0.5
Mycobacterium tuberculosis	Decaprenylphosphoryl-D-2-keto erythro pentose reductase	0.0059	0.0266	0.5
Plasmodium vivax	serine/threonine protein kinase 6, putative	0.0068	0.0339	1
Echinococcus multilocularis	steroid dehydrogenase	0.0059	0.0266	0.028
Onchocerca volvulus	Dehydrogenase\/reductase SDR family member 13 homolog	0.0059	0.0266	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0059	0.0266	0.5
Mycobacterium leprae	Probable oxidoreductase	0.0059	0.0266	0.5
Entamoeba histolytica	protein kinase , putative	0.0068	0.0339	1
Mycobacterium ulcerans	short chain dehydrogenase	0.0059	0.0266	0.5
Echinococcus granulosus	serine:threonine protein kinase 12 B	0.0068	0.0339	0.0356
Onchocerca volvulus		0.0059	0.0266	0.5
Entamoeba histolytica	serine/threonine- protein kinase 6, putative	0.0068	0.0339	1
Mycobacterium ulcerans	short-chain membrane-associated dehydrogenase	0.0059	0.0266	0.5
Trichomonas vaginalis	AGC family protein kinase	0.0068	0.0339	1
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0059	0.0266	0.5
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0059	0.0266	0.5
Brugia malayi	serine/threonine-protein kinase 6	0.0068	0.0339	0.0079
Echinococcus multilocularis	carbonyl reductase 1	0.0059	0.0266	0.028
Echinococcus multilocularis	oxidoreductase	0.0059	0.0266	0.028
Mycobacterium ulcerans	short chain dehydrogenase	0.0059	0.0266	0.5
Echinococcus granulosus	Dehydrogenase:reductase SDR family	0.0059	0.0266	0.028
Onchocerca volvulus		0.0059	0.0266	0.5
Echinococcus multilocularis	Dehydrogenase:reductase SDR family	0.0059	0.0266	0.028
Onchocerca volvulus		0.0059	0.0266	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0059	0.0266	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0059	0.0266	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0059	0.0266	0.5
Mycobacterium tuberculosis	Probable oxidoreductase	0.0059	0.0266	0.5
Mycobacterium ulcerans	ketoacyl reductase	0.0059	0.0266	0.5
Leishmania major	C-8 sterol isomerase-like protein	0.0357	0.2649	0.2448
Mycobacterium ulcerans	dehydrogenase	0.0059	0.0266	0.5
Mycobacterium leprae	Probable short-chain type dehydrogenase/reductase	0.0059	0.0266	0.5
Echinococcus granulosus	retinol dehydrogenase 11	0.0059	0.0266	0.028
Echinococcus granulosus	oxidoreductase	0.0059	0.0266	0.028
Mycobacterium ulcerans	short chain dehydrogenase	0.0059	0.0266	0.5
Echinococcus multilocularis	carbonyl reductase 1	0.0059	0.0266	0.028
Trichomonas vaginalis	AGC family protein kinase	0.0068	0.0339	1
Mycobacterium ulcerans	dehydrogenase/reductase	0.0059	0.0266	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0068	0.0339	1
Echinococcus multilocularis	estradiol 17 beta dehydrogenase 12	0.0059	0.0266	0.028
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0059	0.0266	0.5
Mycobacterium ulcerans	oxidoreductase	0.0059	0.0266	0.5
Plasmodium falciparum	serine/threonine protein kinase, putative	0.0068	0.0339	1
Onchocerca volvulus		0.0059	0.0266	0.5
Brugia malayi	Serotonin receptor	0.0458	0.3456	0.3444

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 7.31 uM	Inhibition of human aurora A	ChEMBL.	20833547

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: CHEMBL1258151

Bibliographic References

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 1258468