TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 412.916 | Formula: C21H25ClN6O
H donors: 3 H acceptors: 3 LogP: 2.92 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: CCC(c1ccc(cc1)Cl)NC(=O)C1(N)CCN(CC1)c1ncnc2c1cc[nH]2
InChi: 1S/C21H25ClN6O/c1-2-17(14-3-5-15(22)6-4-14)27-20(29)21(23)8-11-28(12-9-21)19-16-7-10-24-18(16)25-13-26-19/h3-7,10,13,17H,2,8-9,11-12,23H2,1H3,(H,27,29)(H,24,25,26)
InChiKey: ZFMRDRXPXZUHDB-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	v-akt murine thymoma viral oncogene homolog 1	Starlite/ChEMBL	References
Homo sapiens	v-akt murine thymoma viral oncogene homolog 3	Starlite/ChEMBL	References
Homo sapiens	Rho-associated, coiled-coil containing protein kinase 2	Starlite/ChEMBL	References
Homo sapiens	potassium voltage-gated channel, subfamily H (eag-related), member 2	Starlite/ChEMBL	References
Homo sapiens	v-akt murine thymoma viral oncogene homolog 2	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Trichomonas vaginalis	AGC family protein kinase	Get druggable targets OG5_126635	All targets in OG5_126635
Trichomonas vaginalis	AGC family protein kinase	Get druggable targets OG5_126635	All targets in OG5_126635
Trypanosoma cruzi	Protein kinase B	Get druggable targets OG5_126635	All targets in OG5_126635
Schistosoma japonicum	Sodium/potassium-transporting ATPase subunit beta-1, putative	Get druggable targets OG5_126635	All targets in OG5_126635
Echinococcus granulosus	calcium:calmodulin dependent protein kinase	Get druggable targets OG5_126635	All targets in OG5_126635
Giardia lamblia	Kinase, AGC PKA	Get druggable targets OG5_126635	All targets in OG5_126635
Echinococcus granulosus	potassium voltage gated channel subfamily H	Get druggable targets OG5_128858	All targets in OG5_128858
Brugia malayi	Protein kinase domain containing protein	Get druggable targets OG5_131020	All targets in OG5_131020
Schistosoma japonicum	ko:K04910 potassium voltage-gated channel, Eag-related subfamily H, member 7, putative	Get druggable targets OG5_128858	All targets in OG5_128858
Loa Loa (eye worm)	AGC/DMPK/ROCK protein kinase	Get druggable targets OG5_131020	All targets in OG5_131020
Plasmodium yoelii	kinase Akt/PKB-related	Get druggable targets OG5_126635	All targets in OG5_126635
Entamoeba histolytica	protein kinase 2, putative	Get druggable targets OG5_126635	All targets in OG5_126635
Trichomonas vaginalis	AGC family protein kinase	Get druggable targets OG5_126635	All targets in OG5_126635
Trypanosoma congolense	rac serine-threonine kinase, putative	Get druggable targets OG5_126635	All targets in OG5_126635
Schistosoma japonicum	RAC serine/threonine-protein kinase, putative	Get druggable targets OG5_126635	All targets in OG5_126635
Trichomonas vaginalis	AGC family protein kinase	Get druggable targets OG5_126635	All targets in OG5_126635
Schistosoma japonicum	ko:K08792 serum/glucocorticoid regulated kinase, putative	Get druggable targets OG5_126635	All targets in OG5_126635
Echinococcus multilocularis	Glutaredoxin protein 5	Get druggable targets OG5_126635	All targets in OG5_126635
Schistosoma mansoni	serine/threonine-protein kinase	Get druggable targets OG5_126635	All targets in OG5_126635
Onchocerca volvulus		Get druggable targets OG5_131020	All targets in OG5_131020
Brugia malayi	p70 ribosomal S6 kinase beta	Get druggable targets OG5_126635	All targets in OG5_126635
Loa Loa (eye worm)	AGC/AKT protein kinase	Get druggable targets OG5_126635	All targets in OG5_126635
Plasmodium falciparum	RAC-beta serine/threonine protein kinase	Get druggable targets OG5_126635	All targets in OG5_126635
Schistosoma japonicum	IPR002219,Protein kinase C, phorbol ester/diacylglycerol binding,domain-containing	Get druggable targets OG5_131020	All targets in OG5_131020
Trichomonas vaginalis	AGC family protein kinase	Get druggable targets OG5_126635	All targets in OG5_126635
Echinococcus multilocularis	nervana 2	Get druggable targets OG5_126635	All targets in OG5_126635
Loa Loa (eye worm)	AGC/RSK/P70 protein kinase	Get druggable targets OG5_126635	All targets in OG5_126635
Plasmodium berghei	rac-beta serine/threonine protein kinase, putative	Get druggable targets OG5_126635	All targets in OG5_126635
Loa Loa (eye worm)	voltage and ligand gated potassium channel	Get druggable targets OG5_128858	All targets in OG5_128858
Echinococcus multilocularis	rho associated protein kinase	Get druggable targets OG5_131020	All targets in OG5_131020
Echinococcus granulosus	serine threonine protein kinase nrc	Get druggable targets OG5_126635	All targets in OG5_126635
Schistosoma japonicum	ko:K04456 RAC serine/threonine-protein kinase, putative	Get druggable targets OG5_126635	All targets in OG5_126635
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	Get druggable targets OG5_128858	All targets in OG5_128858
Candida albicans	likely protein kinase similar to S. cerevisiae YPK2 (YMR104C)	Get druggable targets OG5_126635	All targets in OG5_126635
Schistosoma japonicum	Potassium voltage-gated channel subfamily H member 2, putative	Get druggable targets OG5_128858	All targets in OG5_128858
Trypanosoma cruzi	rac serine-threonine kinase, putative	Get druggable targets OG5_126635	All targets in OG5_126635
Schistosoma japonicum	Rho-associated protein kinase 1, putative	Get druggable targets OG5_131020	All targets in OG5_131020
Schistosoma mansoni	voltage-gated potassium channel	Get druggable targets OG5_128858	All targets in OG5_128858
Echinococcus granulosus	serine/threonine protein kinase	Get druggable targets OG5_126635	All targets in OG5_126635
Brugia malayi	Protein kinase domain containing protein	Get druggable targets OG5_126635	All targets in OG5_126635
Schistosoma mansoni	voltage-gated potassium channel	Get druggable targets OG5_128858	All targets in OG5_128858
Echinococcus multilocularis	sodium:potassium dependent atpase beta subunit	Get druggable targets OG5_126635	All targets in OG5_126635
Echinococcus granulosus	nervana 2	Get druggable targets OG5_126635	All targets in OG5_126635
Entamoeba histolytica	PH domain containing protein kinase, putative	Get druggable targets OG5_126635	All targets in OG5_126635
Echinococcus granulosus	Glutaredoxin protein 5	Get druggable targets OG5_126635	All targets in OG5_126635
Echinococcus multilocularis	rac serine:threonine kinase	Get druggable targets OG5_126635	All targets in OG5_126635
Entamoeba histolytica	protein kinase, putative	Get druggable targets OG5_126635	All targets in OG5_126635
Schistosoma mansoni	serine/threonine-protein kinase	Get druggable targets OG5_126635	All targets in OG5_126635
Trichomonas vaginalis	AGC family protein kinase	Get druggable targets OG5_126635	All targets in OG5_126635
Trypanosoma brucei	rac serine-threonine kinase, putative	Get druggable targets OG5_126635	All targets in OG5_126635
Trypanosoma cruzi	rac serine-threonine kinase, putative	Get druggable targets OG5_126635	All targets in OG5_126635
Echinococcus granulosus	nervana 2	Get druggable targets OG5_126635	All targets in OG5_126635
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	Get druggable targets OG5_128858	All targets in OG5_128858
Onchocerca volvulus		Get druggable targets OG5_131020	All targets in OG5_131020
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	Get druggable targets OG5_128858	All targets in OG5_128858
Trypanosoma brucei gambiense	rac serine-threonine kinase, putative,protein kinase, putative	Get druggable targets OG5_126635	All targets in OG5_126635
Schistosoma mansoni	serine/threonine protein kinase	Get druggable targets OG5_131020	All targets in OG5_131020
Echinococcus granulosus	sodium:potassium dependent atpase beta subunit	Get druggable targets OG5_126635	All targets in OG5_126635
Echinococcus multilocularis	serine threonine protein kinase nrc serine threonine protein kinase gad	Get druggable targets OG5_126635	All targets in OG5_126635
Echinococcus multilocularis	potassium voltage gated channel subfamily H	Get druggable targets OG5_128858	All targets in OG5_128858
Plasmodium knowlesi	RAC-beta serine/threonine protein kinase	Get druggable targets OG5_126635	All targets in OG5_126635
Entamoeba histolytica	protein kinase, putative	Get druggable targets OG5_126635	All targets in OG5_126635
Schistosoma japonicum	ko:K07390 monothiol glutaredoxin, putative	Get druggable targets OG5_126635	All targets in OG5_126635
Toxoplasma gondii	AGC kinase	Get druggable targets OG5_126635	All targets in OG5_126635
Schistosoma japonicum	ko:K04910 potassium voltage-gated channel, Eag-related subfamily H, member 7, putative	Get druggable targets OG5_128858	All targets in OG5_128858
Trichomonas vaginalis	AGC family protein kinase	Get druggable targets OG5_126635	All targets in OG5_126635
Entamoeba histolytica	protein kinase, putative	Get druggable targets OG5_126635	All targets in OG5_126635
Entamoeba histolytica	PH domain containing protein kinase, putative	Get druggable targets OG5_126635	All targets in OG5_126635
Neospora caninum	Ribosomal protein S6 kinase alpha-6 (EC 2.7.11.1), related	Get druggable targets OG5_126635	All targets in OG5_126635
Echinococcus multilocularis	nervana 2	Get druggable targets OG5_126635	All targets in OG5_126635
Candida albicans	protein kinase	Get druggable targets OG5_126635	All targets in OG5_126635
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128858	All targets in OG5_128858
Echinococcus granulosus	rho-associated protein kinase 1	Get druggable targets OG5_131020	All targets in OG5_131020
Plasmodium vivax	rac-beta serine/threonine protein kinase, putative	Get druggable targets OG5_126635	All targets in OG5_126635

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	tubulin alpha chain, putative	0.0131	0.2209	0.4464
Echinococcus granulosus	beta tubulin	0.0242	0.4281	1
Brugia malayi	Tubulin gamma chain	0.0131	0.2209	0.2209
Trichomonas vaginalis	tubulin gamma chain, putative	0.0057	0.0822	0.0761
Brugia malayi	protein kinase C II.	0.0043	0.0571	0.0571
Echinococcus granulosus	serine/threonine protein kinase	0.0089	0.142	0.3317
Trichomonas vaginalis	tubulin beta-1 chain, putative	0.0057	0.0822	0.0761
Giardia lamblia	Beta tubulin	0.0242	0.4281	1
Trichomonas vaginalis	tubulin gamma chain, putative	0.0131	0.2209	0.4464
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0183	0.3179	0.7056
Entamoeba histolytica	protein kinase, putative	0.0131	0.2208	0.4412
Echinococcus granulosus	ribosomal protein S6 kinase alpha 3	0.0043	0.0571	0.1333
Echinococcus multilocularis	tubulin alpha chain	0.0183	0.3179	0.7426
Brugia malayi	Cell division protein ftsZ	0.0057	0.0822	0.0822
Schistosoma mansoni	serine/threonine protein kinase	0.0043	0.0571	0.1333
Echinococcus multilocularis	Tubulin beta 2C chain	0.0242	0.4281	1
Leishmania major	beta tubulin	0.0242	0.4281	1
Brugia malayi	alpha-tubulin	0.0183	0.3179	0.3179
Schistosoma mansoni	serine/threonine protein kinase	0.0043	0.0571	0.1333
Brugia malayi	beta-tubulin, identical	0.0242	0.4281	0.4281
Plasmodium vivax	tubulin epsilon chain, putative	0.0131	0.2209	0.4008
Leishmania major	alpha tubulin	0.0183	0.3179	0.6814
Echinococcus granulosus	tubulin alpha 3 chain	0.0183	0.3179	0.7426
Echinococcus granulosus	Tubulin beta 2C chain	0.0242	0.4281	1
Echinococcus multilocularis	hypothetical protein	0.0183	0.3179	0.7426
Echinococcus multilocularis	ribosomal protein s6 kinase beta 1	0.0043	0.0571	0.1333
Echinococcus granulosus	nervana 2	0.0083	0.1303	0.3043
Loa Loa (eye worm)	AGC/RSK/P70 protein kinase	0.0126	0.2115	0.2115
Loa Loa (eye worm)	alpha-tubulin	0.0183	0.3179	0.3179
Schistosoma mansoni	serine/threonine protein kinase	0.0043	0.0571	0.1333
Trichomonas vaginalis	tubulin alpha chain, putative	0.0074	0.1145	0.1623
Echinococcus granulosus	Tubulin alpha 1 chain	0.0183	0.3179	0.7426
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0571	0.0571
Schistosoma mansoni	tubulin subunit epsilon	0.0131	0.2209	0.5159
Echinococcus multilocularis	tubulin subunit TubB	0.0183	0.3179	0.7426
Echinococcus multilocularis	serine:threonine protein kinase N2	0.0043	0.0571	0.1333
Echinococcus multilocularis	Tubulin beta 2C chain	0.0242	0.4281	1
Loa Loa (eye worm)	AGC/NDR protein kinase	0.0043	0.0571	0.0571
Trypanosoma brucei	alpha tubulin, putative	0.0074	0.1145	0.0932
Echinococcus granulosus	nervana 2	0.0083	0.1303	0.3043
Leishmania major	beta tubulin	0.0242	0.4281	1
Trypanosoma brucei	rac serine-threonine kinase, putative	0.0131	0.2208	0.4006
Brugia malayi	Tubulin alpha-2 chain	0.0183	0.3179	0.3179
Trichomonas vaginalis	tubulin, putative	0.0074	0.1145	0.1623
Onchocerca volvulus		0.0177	0.3067	1
Entamoeba histolytica	tubulin alpha-1 chain	0.0183	0.3179	0.703
Trypanosoma cruzi	epsilon tubulin, putative	0.0131	0.2209	0.4008
Echinococcus granulosus	Tubulin beta 2C chain	0.0242	0.4281	1
Schistosoma mansoni	tubulin subunit beta	0.0242	0.4281	1
Toxoplasma gondii	beta-1 tubulin, putative	0.0242	0.4281	1
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0089	0.142	0.2289
Schistosoma mansoni	tubulin subunit alpha	0.0183	0.3179	0.7426
Trypanosoma cruzi	rac serine-threonine kinase, putative	0.0089	0.142	0.1728
Plasmodium vivax	tubulin beta chain, putative	0.0242	0.4281	1
Plasmodium falciparum	tubulin beta chain	0.0242	0.4281	1
Trypanosoma brucei	epsilon tubulin	0.0131	0.2209	0.4008
Echinococcus multilocularis	tubulin alpha chain	0.0183	0.3179	0.7426
Leishmania major	beta tubulin	0.0242	0.4281	1
Leishmania major	epsilon tubulin, putative	0.0131	0.2209	0.4008
Loa Loa (eye worm)	AGC/PKN protein kinase	0.0043	0.0571	0.0571
Trypanosoma cruzi	beta tubulin, putative	0.0242	0.4281	1
Echinococcus granulosus	tubulin epsilon chain	0.0131	0.2209	0.5159
Loa Loa (eye worm)	AGC/RSK/RSK protein kinase	0.0043	0.0571	0.0571
Echinococcus multilocularis	Protein kinase C, brain isozyme	0.0043	0.0571	0.1333
Echinococcus multilocularis	tubulin alpha 1C chain	0.0183	0.3179	0.7426
Echinococcus granulosus	alpha tubulin	0.0183	0.3179	0.7426
Echinococcus granulosus	tubulin alpha chain	0.0183	0.3179	0.7426
Loa Loa (eye worm)	AGC/RSK/MSK protein kinase	0.0043	0.0571	0.0571
Schistosoma mansoni	serine/threonine protein kinase	0.0177	0.3067	0.7163
Loa Loa (eye worm)	tubulin alpha-2 chain	0.0183	0.3179	0.3179
Schistosoma mansoni	tubulin subunit beta	0.0057	0.0822	0.1921
Echinococcus granulosus	tubulin alpha chain	0.0183	0.3179	0.7426
Trichomonas vaginalis	AGC family protein kinase	0.0048	0.0663	0.0336
Echinococcus granulosus	tubulin beta 1 chain	0.0242	0.4281	1
Giardia lamblia	Beta tubulin	0.0242	0.4281	1
Echinococcus multilocularis	tubulin alpha chain	0.0183	0.3179	0.7426
Echinococcus granulosus	peroxisome assembly protein 26	0.0183	0.3179	0.7426
Schistosoma mansoni	serine/threonine-protein kinase	0.0089	0.142	0.3317
Echinococcus multilocularis	nervana 2	0.0083	0.1303	0.3043
Echinococcus granulosus	Ribosomal protein S6 kinase beta 2	0.0043	0.0571	0.1333
Trichomonas vaginalis	tubulin gamma chain, putative	0.0242	0.4281	1
Brugia malayi	tubulin alpha chain - mouse	0.0183	0.3179	0.3179
Leishmania major	alpha tubulin	0.0183	0.3179	0.6814
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0045	0.0592	0.1383
Echinococcus multilocularis	tubulin alpha 1C chain	0.0183	0.3179	0.7426
Echinococcus granulosus	tubulin subunit TubB	0.0183	0.3179	0.7426
Leishmania major	beta tubulin	0.0242	0.4281	1
Trichomonas vaginalis	tubulin, putative	0.0057	0.0822	0.0761
Trichomonas vaginalis	tubulin beta chain, putative	0.0183	0.3179	0.7056
Echinococcus multilocularis	serine threonine protein kinase	0.0043	0.0571	0.1333
Trichomonas vaginalis	AGC family protein kinase	0.0131	0.2208	0.4462
Echinococcus multilocularis	tubulin alpha	0.0131	0.2209	0.5159
Trichomonas vaginalis	AGC family protein kinase	0.0131	0.2208	0.4462
Trypanosoma brucei	epsilon tubulin	0.0131	0.2209	0.4008
Echinococcus multilocularis	tubulin epsilon chain	0.0131	0.2209	0.5159
Leishmania major	beta tubulin	0.0242	0.4281	1
Entamoeba histolytica	protein kinase, putative	0.0131	0.2208	0.4412
Brugia malayi	tubulin alpha-2 chain	0.0183	0.3179	0.3179
Toxoplasma gondii	beta-tubulin, putative	0.0242	0.4281	1
Trichomonas vaginalis	AGC family protein kinase	0.0131	0.2208	0.4462
Trichomonas vaginalis	tubulin beta chain, putative	0.0183	0.3179	0.7056
Echinococcus granulosus	Tubulin alpha 1 chain	0.0183	0.3179	0.7426
Schistosoma mansoni	tubulin subunit alpha	0.0057	0.0822	0.1921
Echinococcus granulosus	tubulin subunit beta	0.0242	0.4281	1
Leishmania major	beta tubulin	0.0242	0.4281	1
Echinococcus granulosus	tubulin delta chain	0.0057	0.0822	0.1921
Schistosoma mansoni	tubulin subunit alpha	0.0183	0.3179	0.7426
Toxoplasma gondii	AGC kinase	0.0126	0.2115	0.3737
Loa Loa (eye worm)	tubulin beta-1 chain	0.0242	0.4281	0.4281
Echinococcus multilocularis	Glutaredoxin protein 5	0.0083	0.1303	0.3043
Echinococcus multilocularis	protein kinase c epsilon type	0.0043	0.0571	0.1333
Echinococcus granulosus	tubulin alpha chain	0.0183	0.3179	0.7426
Echinococcus multilocularis	serine:threonine protein kinase N2	0.0043	0.0571	0.1333
Loa Loa (eye worm)	AGC/PKC/ETA protein kinase	0.0043	0.0571	0.0571
Leishmania major	beta tubulin	0.0242	0.4281	1
Toxoplasma gondii	alpha tubulin TUBA1	0.0183	0.3179	0.6814
Trichomonas vaginalis	tubulin alpha chain, putative	0.0242	0.4281	1
Mycobacterium leprae	cell division protein FtsZ	0.0057	0.0822	0.5
Leishmania major	alpha tubulin	0.0183	0.3179	0.6814
Plasmodium falciparum	alpha tubulin 1	0.0183	0.3179	0.6814
Trichomonas vaginalis	AGC family protein kinase	0.0131	0.2208	0.4462
Trichomonas vaginalis	serine/threonine-protein kinase sgk, putative	0.0042	0.0546	0.0024
Leishmania major	beta tubulin	0.0242	0.4281	1
Giardia lamblia	Gamma tubulin	0.0131	0.2209	0.4008
Brugia malayi	Protein kinase domain containing protein	0.0043	0.0571	0.0571
Onchocerca volvulus		0.0175	0.3043	0.9873
Echinococcus multilocularis	tubulin delta chain	0.0057	0.0822	0.1921
Trichomonas vaginalis	AGC family protein kinase	0.0043	0.0571	0.0089
Trypanosoma brucei	alpha tubulin	0.0183	0.3179	0.6814
Entamoeba histolytica	tubulin family protein	0.0242	0.4281	1
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0089	0.142	0.2289
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0242	0.4281	1
Schistosoma mansoni	alpha tubulin	0.0183	0.3179	0.7426
Trichomonas vaginalis	tubulin alpha chain, putative	0.0074	0.1145	0.1623
Leishmania major	gamma-tubulin	0.0131	0.2209	0.4008
Mycobacterium tuberculosis	Cell division protein FtsZ	0.0057	0.0822	0.5
Plasmodium vivax	tubulin alpha chain, putative	0.0183	0.3179	0.6814
Echinococcus granulosus	tubulin alpha chain	0.0183	0.3179	0.7426
Schistosoma mansoni	alpha tubulin	0.0183	0.3179	0.7426
Echinococcus multilocularis	beta tubulin	0.0242	0.4281	1
Loa Loa (eye worm)	tubulin beta-4 chain	0.0242	0.4281	0.4281
Schistosoma mansoni	tubulin subunit delta	0.0057	0.0822	0.1921
Trypanosoma brucei	beta tubulin	0.0242	0.4281	1
Leishmania major	beta tubulin	0.0242	0.4281	1
Leishmania major	alpha tubulin	0.0183	0.3179	0.6814
Echinococcus granulosus	rho-associated protein kinase 1	0.0177	0.3067	0.7163
Echinococcus multilocularis	ribosomal protein S6 kinase alpha 3	0.0043	0.0571	0.1333
Loa Loa (eye worm)	alpha-tubulin isotype 2	0.0126	0.2115	0.2115
Trichomonas vaginalis	tubulin beta chain, putative	0.0183	0.3179	0.7056
Echinococcus multilocularis	beta tubulin	0.0242	0.4281	1
Trypanosoma brucei	beta tubulin	0.0131	0.2209	0.4008
Leishmania major	alpha tubulin	0.0183	0.3179	0.6814
Loa Loa (eye worm)	tubulin alpha chain	0.0183	0.3179	0.3179
Echinococcus granulosus	sodium:potassium dependent atpase beta subunit	0.0083	0.1303	0.3043
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0183	0.3179	0.7426
Schistosoma mansoni	voltage-gated potassium channel	0.0049	0.0669	0.1562
Loa Loa (eye worm)	tubulin alpha 2	0.0126	0.2115	0.2115
Loa Loa (eye worm)	AGC/AKT protein kinase	0.0131	0.2208	0.2208
Loa Loa (eye worm)	tubulin alpha 2	0.0052	0.0729	0.0729
Trichomonas vaginalis	tubulin, putative	0.0242	0.4281	1
Trichomonas vaginalis	tubulin gamma chain, putative	0.0131	0.2209	0.4464
Trichomonas vaginalis	conserved hypothetical protein	0.0057	0.0822	0.0761
Trichomonas vaginalis	tubulin beta chain, putative	0.0242	0.4281	1
Brugia malayi	Tubulin alpha chain	0.0183	0.3179	0.3179
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0126	0.2115	0.4215
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0109	0.1793	0.3353
Leishmania major	beta tubulin	0.0242	0.4281	1
Schistosoma mansoni	alpha tubulin	0.0183	0.3179	0.7426
Leishmania major	alpha tubulin	0.0183	0.3179	0.6814
Brugia malayi	Tubulin beta chain	0.0074	0.1145	0.1145
Loa Loa (eye worm)	tubulin gamma chain	0.0131	0.2209	0.2209
Leishmania major	beta tubulin	0.0242	0.4281	1
Loa Loa (eye worm)	tubulin beta chain	0.0242	0.4281	0.4281
Leishmania major	beta tubulin	0.0242	0.4281	1
Loa Loa (eye worm)	hypothetical protein	0.0126	0.2115	0.2115
Echinococcus granulosus	Tubulin alpha 1 chain	0.0183	0.3179	0.7426
Entamoeba histolytica	protein kinase 2, putative	0.0084	0.1327	0.2039
Brugia malayi	Protein kinase domain containing protein	0.0043	0.0571	0.0571
Echinococcus multilocularis	Ribosomal protein S6 kinase beta 2	0.0043	0.0571	0.1333
Leishmania major	beta tubulin	0.0242	0.4281	1
Giardia lamblia	Alpha-tubulin	0.0183	0.3179	0.6814
Echinococcus granulosus	protein kinase C gamma type	0.0043	0.0571	0.1333
Trypanosoma brucei	epsilon tubulin	0.0131	0.2209	0.4008
Echinococcus multilocularis	tubulin alpha 3 chain	0.0183	0.3179	0.7426
Leishmania major	alpha tubulin	0.0183	0.3179	0.6814
Schistosoma mansoni	serine/threonine kinase	0.0043	0.0571	0.1333
Echinococcus granulosus	calcium:calmodulin dependent protein kinase	0.0084	0.1327	0.31
Entamoeba histolytica	protein kinase, putative	0.0126	0.2115	0.4162
Leishmania major	beta tubulin	0.0242	0.4281	1
Brugia malayi	Tubulin alpha-2 chain	0.0183	0.3179	0.3179
Echinococcus multilocularis	nervana 2	0.0083	0.1303	0.3043
Echinococcus multilocularis	tubulin alpha 3 chain	0.0183	0.3179	0.7426
Plasmodium falciparum	RAC-beta serine/threonine protein kinase	0.0084	0.1327	0.146
Schistosoma mansoni	serine/threonine protein kinase	0.0043	0.0571	0.1333
Loa Loa (eye worm)	alpha-tubulin	0.0183	0.3179	0.3179
Schistosoma mansoni	tubulin subunit beta	0.0242	0.4281	1
Trichomonas vaginalis	AGC family protein kinase	0.0131	0.2208	0.4462
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0057	0.0822	0.0761
Schistosoma mansoni	serine/threonine protein kinase	0.0043	0.0571	0.1333
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0183	0.3179	0.7056
Entamoeba histolytica	tubulin family protein	0.0242	0.4281	1
Echinococcus granulosus	serine threonine protein kinase nrc	0.0084	0.1327	0.31
Echinococcus multilocularis	peroxisome assembly protein 26	0.0183	0.3179	0.7426
Echinococcus multilocularis	serine threonine protein kinase nrc serine threonine protein kinase gad	0.0084	0.1327	0.31
Echinococcus granulosus	Tubulin beta 2C chain	0.0242	0.4281	1
Leishmania major	alpha tubulin	0.0183	0.3179	0.6814
Schistosoma mansoni	atypical protein kinase C	0.0043	0.0571	0.1333
Echinococcus multilocularis	sodium:potassium dependent atpase beta subunit	0.0083	0.1303	0.3043
Trypanosoma brucei	alpha tubulin	0.0183	0.3179	0.6814
Schistosoma mansoni	tubulin subunit gamma	0.0131	0.2209	0.5159
Loa Loa (eye worm)	tubulin beta-2A chain	0.0242	0.4281	0.4281
Trichomonas vaginalis	tubulin beta chain, putative	0.0183	0.3179	0.7056
Trichomonas vaginalis	tubulin beta chain, putative	0.0074	0.1145	0.1623
Loa Loa (eye worm)	hypothetical protein	0.0109	0.1793	0.1793
Trypanosoma brucei	beta tubulin	0.0242	0.4281	1
Leishmania major	alpha tubulin	0.0183	0.3179	0.6814
Echinococcus granulosus	ribosomal protein s6 kinase beta 1	0.0043	0.0571	0.1333
Trichomonas vaginalis	AGC family protein kinase	0.0131	0.2208	0.4462
Brugia malayi	Tubulin alpha chain	0.0057	0.0822	0.0822
Loa Loa (eye worm)	tubulin beta chain	0.0057	0.0822	0.0822
Wolbachia endosymbiont of Brugia malayi	cell division protein FtsZ	0.0057	0.0822	0.5
Giardia lamblia	Beta tubulin	0.0242	0.4281	1
Plasmodium vivax	tubulin gamma chain, putative	0.0131	0.2209	0.4008
Echinococcus granulosus	tubulin alpha	0.0131	0.2209	0.5159
Echinococcus granulosus	serine:threonine protein kinase N2	0.0043	0.0571	0.1333
Loa Loa (eye worm)	tubulin alpha-3 chain	0.0109	0.1793	0.1793
Schistosoma mansoni	tubulin subunit beta	0.0242	0.4281	1
Brugia malayi	Tubulin beta-1 chain	0.0242	0.4281	0.4281
Entamoeba histolytica	tubulin gamma chain	0.0131	0.2209	0.4415
Echinococcus multilocularis	rho associated protein kinase	0.0177	0.3067	0.7163
Loa Loa (eye worm)	BEN-1 protein	0.0242	0.4281	0.4281
Echinococcus granulosus	tubulin beta 4A class IVa	0.0242	0.4281	1
Echinococcus granulosus	tubulin gamma 1 chain	0.0131	0.2209	0.5159
Echinococcus multilocularis	tubulin alpha chain	0.0183	0.3179	0.7426
Loa Loa (eye worm)	tubulin alpha chain	0.0183	0.3179	0.3179
Leishmania major	beta tubulin	0.0242	0.4281	1
Treponema pallidum	cell division protein FtsZ	0.0057	0.0822	0.5
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0045	0.0592	0.1383
Echinococcus multilocularis	Tubulin beta 2C chain	0.0242	0.4281	1
Trichomonas vaginalis	AGC family protein kinase	0.0131	0.2208	0.4462
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.0045	0.0592	0.0592
Echinococcus granulosus	beta tubulin	0.0242	0.4281	1
Leishmania major	alpha tubulin	0.0183	0.3179	0.6814
Echinococcus granulosus	protein kinase c epsilon type	0.0043	0.0571	0.1333
Trichomonas vaginalis	tubulin alpha chain, putative	0.0074	0.1145	0.1623
Echinococcus multilocularis	tubulin beta 1 chain	0.0242	0.4281	1
Echinococcus granulosus	tubulin alpha 1C chain	0.0183	0.3179	0.7426
Echinococcus multilocularis	Tubulin beta 2C chain	0.0242	0.4281	1
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0074	0.1145	0.1623
Giardia lamblia	Kinase, AGC PKA	0.0084	0.1327	0.146
Trypanosoma brucei	alpha tubulin	0.0183	0.3179	0.6814
Plasmodium falciparum	alpha tubulin 2	0.0183	0.3179	0.6814
Echinococcus multilocularis	rac serine:threonine kinase	0.0089	0.142	0.3317
Echinococcus granulosus	Tubulin beta 2C chain	0.0242	0.4281	1
Trypanosoma brucei	beta tubulin	0.0242	0.4281	1
Schistosoma mansoni	tubulin subunit beta	0.0242	0.4281	1
Echinococcus granulosus	Tubulin beta 2C chain	0.0242	0.4281	1
Brugia malayi	Tubulin beta chain	0.0057	0.0822	0.0822
Schistosoma mansoni	voltage-gated potassium channel	0.0049	0.0669	0.1562
Trypanosoma brucei	tubulin gamma chain	0.0131	0.2209	0.4008
Loa Loa (eye worm)	AGC/DMPK/GEK protein kinase	0.0043	0.0571	0.0571
Giardia lamblia	Alpha-tubulin	0.0183	0.3179	0.6814
Loa Loa (eye worm)	BEN-1 protein	0.0242	0.4281	0.4281
Loa Loa (eye worm)	hypothetical protein	0.0183	0.3179	0.3179
Trypanosoma cruzi	alpha tubulin, putative	0.0183	0.3179	0.6814
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0183	0.3179	0.7426
Echinococcus multilocularis	serine:threonine protein kinase 38	0.0043	0.0571	0.1333
Trypanosoma cruzi	tubulin gamma chain	0.0131	0.2209	0.4008
Schistosoma mansoni	serine/threonine protein kinase	0.0043	0.0571	0.1333
Plasmodium falciparum	tubulin epsilon chain, putative	0.0131	0.2209	0.4008
Brugia malayi	Hr1 repeat family protein	0.0043	0.0571	0.0571
Plasmodium vivax	tubulin alpha chain, putative	0.0183	0.3179	0.6814
Echinococcus granulosus	NDR protein kinase	0.0043	0.0571	0.1333
Echinococcus granulosus	tubulin alpha 1C chain	0.0183	0.3179	0.7426
Trypanosoma cruzi	Protein kinase B	0.0089	0.142	0.1728
Toxoplasma gondii	alpha-tubulin I, putative	0.0183	0.3179	0.6814
Brugia malayi	p70 ribosomal S6 kinase beta	0.0126	0.2115	0.2115
Trypanosoma brucei	alpha tubulin	0.0183	0.3179	0.6814
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.0045	0.0592	0.0592
Entamoeba histolytica	tubulin alpha chain, putative	0.0183	0.3179	0.703
Echinococcus granulosus	tubulin alpha 3 chain	0.0183	0.3179	0.7426
Trichomonas vaginalis	tubulin, putative	0.0074	0.1145	0.1623
Leishmania major	alpha tubulin	0.0183	0.3179	0.6814
Echinococcus multilocularis	protein kinase c iota type	0.0043	0.0571	0.1333
Trichomonas vaginalis	tubulin beta chain, putative	0.0183	0.3179	0.7056
Trypanosoma brucei	beta tubulin	0.0242	0.4281	1
Leishmania major	beta tubulin	0.0242	0.4281	1
Echinococcus multilocularis	tubulin gamma 1 chain	0.0131	0.2209	0.5159
Trypanosoma cruzi	epsilon tubulin, putative	0.0131	0.2209	0.4008
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0183	0.3179	0.7056
Schistosoma mansoni	serine/threonine-protein kinase	0.0089	0.142	0.3317
Loa Loa (eye worm)	beta-tubulin	0.0242	0.4281	0.4281
Leishmania major	beta tubulin	0.0242	0.4281	1
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0242	0.4281	1
Leishmania major	beta tubulin	0.0242	0.4281	1
Toxoplasma gondii	tubulin/FtsZ family, GTPase domain-containing protein	0.0131	0.2209	0.4008
Brugia malayi	Protein kinase domain containing protein	0.0131	0.2208	0.2208
Echinococcus multilocularis	tubulin alpha chain	0.0183	0.3179	0.7426
Echinococcus granulosus	protein kinase c iota type	0.0043	0.0571	0.1333
Echinococcus granulosus	tubulin alpha chain	0.0183	0.3179	0.7426
Echinococcus granulosus	Glutaredoxin protein 5	0.0083	0.1303	0.3043
Echinococcus multilocularis	Tubulin beta 2C chain	0.0242	0.4281	1
Plasmodium vivax	rac-beta serine/threonine protein kinase, putative	0.0084	0.1327	0.146
Schistosoma mansoni	tubulin subunit beta	0.0242	0.4281	1
Loa Loa (eye worm)	tubulin alpha 2	0.0126	0.2115	0.2115
Schistosoma mansoni	serine/threonine protein kinase	0.0043	0.0571	0.1333
Schistosoma mansoni	tubulin subunit alpha	0.0183	0.3179	0.7426
Trichomonas vaginalis	conserved hypothetical protein	0.0057	0.0822	0.0761
Mycobacterium ulcerans	cell division protein FtsZ	0.0057	0.0822	0.5
Trypanosoma cruzi	rac serine-threonine kinase, putative	0.0084	0.1327	0.146
Plasmodium falciparum	tubulin gamma chain	0.0131	0.2209	0.4008
Toxoplasma gondii	beta tubulin	0.0242	0.4281	1
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0183	0.3179	0.7426
Echinococcus multilocularis	tubulin subunit beta	0.0242	0.4281	1
Leishmania major	alpha tubulin	0.0183	0.3179	0.6814
Trichomonas vaginalis	AGC family protein kinase	0.0043	0.0571	0.0089
Trichomonas vaginalis	tubulin beta chain, putative	0.0183	0.3179	0.7056
Echinococcus granulosus	Protein kinase C brain isozyme	0.0043	0.0571	0.1333
Trichomonas vaginalis	AGC family protein kinase	0.0043	0.0571	0.0089
Schistosoma mansoni	tubulin subunit beta	0.0242	0.4281	1
Echinococcus multilocularis	tubulin, beta 4A class IVa	0.0242	0.4281	1
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0482	0.0482

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 7 nM	Inhibition of recombinant Akt1 (unknown origin) using 5-FAM-labeled peptide as substrate after 1 hr by caliper off-chip incubation mobility shift assay	ChEMBL.	23394218
IC50 (binding)	= 15 nM	Inhibition of recombinant Akt3 (unknown origin) using 5-FAM-labeled peptide as substrate after 1 hr by caliper off-chip incubation mobility shift assay	ChEMBL.	23394218
IC50 (binding)	= 23 nM	Inhibition of recombinant Akt2 (unknown origin) using 5-FAM-labeled peptide as substrate after 1 hr by caliper off-chip incubation mobility shift assay	ChEMBL.	23394218
IC50 (binding)	= 126 nM	Inhibition of recombinant ROCK2 (unknown origin) using 5-FAM-labeled peptide as substrate after 1 hr by caliper off-chip incubation mobility shift assay	ChEMBL.	23394218
IC50 (binding)	= 6495 nM	Inhibition of human ERG expressed in CHO cells by ionworks assay	ChEMBL.	23394218

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: CHEMBL2325982

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 1726629