TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 738.415 | Formula: C29H12F6N4O13
H donors: 1 H acceptors: 10 LogP: 7.52 Rotable bonds: 11
Rule of 5 violations (Lipinski): 2
SMILES: Oc1cc(cc2c1c(=O)cc(o2)c1ccc(cc1)Oc1c(cc(cc1C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-])Oc1c(cc(cc1C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]
InChi: 1S/C29H12F6N4O13/c30-28(31,32)17-5-13(36(42)43)7-19(38(46)47)26(17)50-15-3-1-12(2-4-15)23-11-22(41)25-21(40)9-16(10-24(25)52-23)51-27-18(29(33,34)35)6-14(37(44)45)8-20(27)39(48)49/h1-11,40H
InChiKey: LDXKSJWWEDPFAQ-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	kinesin family member 11	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Plasmodium falciparum	kinesin-5	Get druggable targets OG5_128460	All targets in OG5_128460
Loa Loa (eye worm)	kinesin-like protein KLP2	Get druggable targets OG5_128460	All targets in OG5_128460
Giardia lamblia	Kinesin-5	Get druggable targets OG5_128460	All targets in OG5_128460
Plasmodium vivax	kinesin-5	Get druggable targets OG5_128460	All targets in OG5_128460
Schistosoma mansoni	kinesin eg-5	Get druggable targets OG5_128460	All targets in OG5_128460
Plasmodium yoelii	Kinesin motor domain, putative	Get druggable targets OG5_128460	All targets in OG5_128460
Entamoeba histolytica	kinesin, putative	Get druggable targets OG5_128460	All targets in OG5_128460
Candida albicans	kinesin motor domain protein similar to S. cerevisiae KIP1 (YBL063W) microtubule motor complex protein	Get druggable targets OG5_128460	All targets in OG5_128460
Cryptosporidium hominis	kinesin-like boursin	Get druggable targets OG5_128460	All targets in OG5_128460
Echinococcus granulosus	kinesin family 1	Get druggable targets OG5_128460	All targets in OG5_128460
Brugia malayi	Kinesin motor domain containing protein	Get druggable targets OG5_128460	All targets in OG5_128460
Plasmodium berghei	kinesin-5, putative	Get druggable targets OG5_128460	All targets in OG5_128460
Candida albicans	kinesin motor domain protein similar to S. cerevisiae KIP1 (YBL063W) microtubule motor complex protein	Get druggable targets OG5_128460	All targets in OG5_128460
Schistosoma japonicum	ko:K10398 kinesin family member 11, putative	Get druggable targets OG5_128460	All targets in OG5_128460
Cryptosporidium parvum	kinesin-like boursin, putative	Get druggable targets OG5_128460	All targets in OG5_128460
Echinococcus multilocularis	kinesin family 1	Get druggable targets OG5_128460	All targets in OG5_128460
Plasmodium knowlesi	kinesin-5, putative	Get druggable targets OG5_128460	All targets in OG5_128460
Neospora caninum	hypothetical protein	Get druggable targets OG5_128460	All targets in OG5_128460
Toxoplasma gondii	kinesin motor domain-containing protein	Get druggable targets OG5_128460	All targets in OG5_128460

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	cysteine peptidase, putative	0.0024	0.0676	1
Brugia malayi	Papain family cysteine protease containing protein	0.0024	0.0676	0.6564
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0013	0.0181	0.0144
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0012	0.0174	0.1895
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0024	0.0676	0.6564
Echinococcus granulosus	Tubulin alpha 1 chain	0.0018	0.0401	0.0346
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0013	0.0181	0.0144
Trypanosoma brucei	alpha tubulin	0.0018	0.0401	0.5565
Echinococcus granulosus	cathepsin l1	0.0024	0.0676	0.0622
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0024	0.0676	1
Echinococcus multilocularis	cathepsin L cysteine protease	0.0024	0.0676	0.0622
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0024	0.0676	0.6759
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0024	0.0676	1
Echinococcus multilocularis	cysteine protease	0.0024	0.0676	0.0622
Echinococcus multilocularis	tubulin alpha 3 chain	0.0018	0.0401	0.0346
Entamoeba histolytica	cysteine protease, putative	0.0013	0.0181	0.1317
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0024	0.0676	1
Echinococcus granulosus	tubulin alpha chain	0.0018	0.0401	0.0346
Onchocerca volvulus		0.0024	0.0676	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0024	0.0676	1
Echinococcus granulosus	tubulin alpha 3 chain	0.0018	0.0401	0.0346
Entamoeba histolytica	cysteine proteinase 1, putative	0.0013	0.0181	0.1317
Loa Loa (eye worm)	tubulin alpha chain	0.0018	0.0401	0.4014
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0024	0.0676	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0024	0.0676	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0024	0.0676	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0013	0.0181	0.2007
Brugia malayi	Kinesin motor domain containing protein	0.0032	0.1	1
Entamoeba histolytica	cysteine proteinase, putative	0.0013	0.0181	0.1317
Leishmania major	alpha tubulin	0.0018	0.0401	0.5565
Trypanosoma cruzi	alpha tubulin, putative	0.0018	0.0401	0.5565
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0018	0.0401	0.5565
Loa Loa (eye worm)	alpha-tubulin	0.0018	0.0401	0.4014
Entamoeba histolytica	cysteine proteinase, putative	0.0013	0.0181	0.1317
Trypanosoma cruzi	cysteine peptidase, putative	0.0013	0.0181	0.2007
Schistosoma mansoni	cathepsin F (C01 family)	0.0016	0.0338	0.0327
Loa Loa (eye worm)	tubulin beta chain	0.001	0.0057	0.057
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0338	0.3386
Entamoeba histolytica	cysteine protease, putative	0.0013	0.0181	0.1317
Schistosoma mansoni	cathepsin F (C01 family)	0.0024	0.0676	0.0719
Echinococcus granulosus	tubulin alpha chain	0.0018	0.0401	0.0346
Trypanosoma cruzi	cysteine proteinase, putative	0.0013	0.0181	0.2007
Toxoplasma gondii	alpha-tubulin I, putative	0.0018	0.0401	0.3653
Trypanosoma cruzi	cruzipain precursor, putative	0.0024	0.0676	1
Loa Loa (eye worm)	BEN-1 protein	0.001	0.0057	0.057
Leishmania major	cathepsin L-like protease	0.0024	0.0676	1
Brugia malayi	Tubulin alpha-2 chain	0.0018	0.0401	0.3653
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0024	0.0676	0.0622
Giardia lamblia	Kinesin-5	0.0032	0.1	1
Toxoplasma gondii	cathepsin CPL	0.0024	0.0676	0.6564
Entamoeba histolytica	cysteine protease, putative	0.0024	0.0676	0.6564
Echinococcus multilocularis	cathepsin L cysteine protease	0.0024	0.0676	0.0622
Schistosoma mansoni	kinesin eg-5	0.0032	0.1	0.1096
Onchocerca volvulus		0.0024	0.0676	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0024	0.0676	1
Brugia malayi	Cathepsin L-like precursor	0.0024	0.0676	0.6564
Entamoeba histolytica	cysteine protease, putative	0.0013	0.0181	0.1317
Leishmania major	alpha tubulin	0.0018	0.0401	0.5565
Trypanosoma cruzi	cysteine protease, putative	0.0013	0.0181	0.2007
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0024	0.0676	1
Loa Loa (eye worm)	tubulin alpha-3 chain	0.0012	0.0174	0.1743
Toxoplasma gondii	kinesin motor domain-containing protein	0.0032	0.1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0024	0.0676	1
Schistosoma mansoni	tubulin subunit alpha	0.0018	0.0401	0.04
Loa Loa (eye worm)	tubulin beta-1 chain	0.001	0.0057	0.057
Entamoeba histolytica	kinesin, putative	0.0032	0.1	1
Schistosoma mansoni	hypothetical protein	0.0215	0.8656	1
Loa Loa (eye worm)	kinesin-like protein KLP2	0.0032	0.1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0024	0.0676	1
Echinococcus multilocularis	cathepsin L	0.0013	0.0181	0.0125
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0024	0.0676	1
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.0013	0.0181	0.2007
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0024	0.0676	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0024	0.0676	1
Plasmodium falciparum	cysteine proteinase falcipain 1	0.0013	0.0181	0.1317
Loa Loa (eye worm)	alpha-tubulin	0.0018	0.0401	0.4014
Trypanosoma cruzi	cysteine peptidase, putative	0.0024	0.0676	1
Plasmodium falciparum	alpha tubulin 2	0.0018	0.0401	0.3653
Schistosoma mansoni	tubulin subunit alpha	0.0018	0.0401	0.04
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0013	0.0181	0.0144
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0013	0.0181	0.2007
Echinococcus granulosus	tubulin alpha chain	0.0018	0.0401	0.0346
Echinococcus granulosus	Tubulin alpha 1 chain	0.0018	0.0401	0.0346
Brugia malayi	tubulin alpha-2 chain	0.0018	0.0401	0.3653
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0024	0.0676	1
Entamoeba histolytica	cysteine proteinase, putative	0.0013	0.0181	0.1317
Loa Loa (eye worm)	ctsf protein	0.0024	0.0676	0.6759
Brugia malayi	Cathepsin L-like precursor	0.0024	0.0676	0.6564
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0024	0.0676	1
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0016	0.0338	0.455
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0018	0.0401	0.5565
Leishmania major	alpha tubulin	0.0018	0.0401	0.5565
Entamoeba histolytica	cysteine protease, putative	0.0013	0.0181	0.1317
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0024	0.0676	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0024	0.0676	1
Trypanosoma cruzi	cysteine proteinase, putative	0.0013	0.0181	0.2007
Entamoeba histolytica	cysteine proteinase, putative	0.0024	0.0676	0.6564
Leishmania major	alpha tubulin	0.0018	0.0401	0.5565
Giardia lamblia	Alpha-tubulin	0.0018	0.0401	0.3653
Loa Loa (eye worm)	fibroinase	0.0024	0.0676	0.6759
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0024	0.0676	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0013	0.0181	0.2007
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0024	0.0676	1
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0014	0.0227	0.2749
Plasmodium vivax	vivapain-1	0.0013	0.0181	0.1317
Plasmodium vivax	kinesin-5	0.0032	0.1	1
Plasmodium vivax	unspecified product	0.0013	0.0181	0.1317
Echinococcus granulosus	tubulin alpha 1C chain	0.0018	0.0401	0.0346
Onchocerca volvulus		0.0024	0.0676	1
Plasmodium vivax	vivapain-3	0.0013	0.0181	0.1317
Echinococcus multilocularis	tubulin alpha 3 chain	0.0018	0.0401	0.0346
Leishmania major	cathepsin L-like protease	0.0024	0.0676	1
Brugia malayi	Cathepsin L-like precursor	0.0024	0.0676	0.6564
Echinococcus granulosus	tubulin alpha chain	0.0018	0.0401	0.0346
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0024	0.0676	0.0622
Onchocerca volvulus	Cathepsin F homolog	0.0024	0.0676	1
Leishmania major	alpha tubulin	0.0018	0.0401	0.5565
Loa Loa (eye worm)	tubulin beta-4 chain	0.001	0.0057	0.057
Plasmodium falciparum	alpha tubulin 1	0.0018	0.0401	0.3653
Loa Loa (eye worm)	tubulin alpha-2 chain	0.0018	0.0401	0.4014
Leishmania major	cathepsin L-like protease	0.0024	0.0676	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0024	0.0676	1
Leishmania major	alpha tubulin	0.0018	0.0401	0.5565
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0024	0.0676	1
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0016	0.0338	0.2986
Echinococcus granulosus	tubulin subunit TubB	0.0018	0.0401	0.0346
Trichomonas vaginalis	tubulin beta chain, putative	0.0018	0.0401	0.5565
Entamoeba histolytica	cysteine protease, putative	0.0013	0.0181	0.1317
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0024	0.0676	0.6759
Leishmania major	cathepsin L-like protease	0.0024	0.0676	1
Entamoeba histolytica	cysteine protease, putative	0.0013	0.0181	0.1317
Loa Loa (eye worm)	tubulin alpha chain	0.0018	0.0401	0.4014
Toxoplasma gondii	alpha tubulin TUBA1	0.0018	0.0401	0.3653
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0016	0.0338	0.455
Echinococcus granulosus	cysteine protease	0.0013	0.0181	0.0125
Echinococcus multilocularis	tubulin alpha 1C chain	0.0018	0.0401	0.0346
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0024	0.0676	0.0622
Brugia malayi	Cathepsin L-like precursor	0.0024	0.0676	0.6564
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0338	0.3386
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0018	0.0401	0.0346
Brugia malayi	Papain family cysteine protease containing protein	0.0013	0.0181	0.1317
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0018	0.0401	0.5565
Leishmania major	cysteine peptidase A (CPA)	0.0024	0.0676	1
Loa Loa (eye worm)	beta-tubulin	0.001	0.0057	0.057
Brugia malayi	Tubulin alpha chain	0.0018	0.0401	0.3653
Echinococcus multilocularis	kinesin family 1	0.0247	1	1
Entamoeba histolytica	cysteine protease, putative	0.0013	0.0181	0.1317
Entamoeba histolytica	cysteine proteinase, putative	0.0024	0.0676	0.6564
Echinococcus granulosus	cathepsin L cysteine protease	0.0013	0.0181	0.0125
Onchocerca volvulus		0.0024	0.0676	1
Loa Loa (eye worm)	cysteine protease	0.0024	0.0676	0.6759
Brugia malayi	Cathepsin L-like precursor	0.0024	0.0676	0.6564
Onchocerca volvulus		0.0024	0.0676	1
Entamoeba histolytica	cysteine protease, putative	0.0013	0.0181	0.1317
Leishmania major	alpha tubulin	0.0018	0.0401	0.5565
Leishmania major	alpha tubulin	0.0018	0.0401	0.5565
Schistosoma mansoni	alpha tubulin	0.0018	0.0401	0.04
Trypanosoma brucei	alpha tubulin	0.0018	0.0401	0.5565
Entamoeba histolytica	cysteine protease, putative	0.0013	0.0181	0.1317
Brugia malayi	cathepsin L-like precursor	0.0016	0.0338	0.2986
Echinococcus granulosus	Tubulin alpha 1 chain	0.0018	0.0401	0.0346
Onchocerca volvulus	Cathepsin L homolog	0.0024	0.0676	1
Entamoeba histolytica	cysteine protease, putative	0.0013	0.0181	0.1317
Brugia malayi	alpha-tubulin	0.0018	0.0401	0.3653
Plasmodium vivax	tubulin alpha chain, putative	0.0018	0.0401	0.3653
Brugia malayi	Cathepsin L-like precursor	0.0016	0.0338	0.2986
Plasmodium vivax	vivapain-2	0.0024	0.0676	0.6564
Leishmania major	cathepsin L-like protease	0.0024	0.0676	1
Leishmania major	alpha tubulin	0.0018	0.0401	0.5565
Loa Loa (eye worm)	tubulin alpha 2	0.0014	0.0227	0.2271
Echinococcus granulosus	cathepsin L	0.0013	0.0181	0.0125
Plasmodium falciparum	kinesin-5	0.0032	0.1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0024	0.0676	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0024	0.0676	1
Onchocerca volvulus	Cathepsin L homolog	0.0024	0.0676	1
Trichomonas vaginalis	tubulin beta chain, putative	0.0018	0.0401	0.5565
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0024	0.0676	1
Echinococcus multilocularis	tubulin alpha 1C chain	0.0018	0.0401	0.0346
Brugia malayi	Cathepsin L-like precursor	0.0024	0.0676	0.6564
Leishmania major	cathepsin L-like protease	0.0024	0.0676	1
Loa Loa (eye worm)	tubulin beta-2A chain	0.001	0.0057	0.057
Trypanosoma brucei	alpha tubulin	0.0018	0.0401	0.5565
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0024	0.0676	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0024	0.0676	1
Trichomonas vaginalis	tubulin beta chain, putative	0.0018	0.0401	0.5565
Entamoeba histolytica	cysteine proteinase, putative	0.0013	0.0181	0.1317
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0013	0.0181	0.2007
Echinococcus granulosus	tubulin alpha 3 chain	0.0018	0.0401	0.0346
Schistosoma mansoni	alpha tubulin	0.0018	0.0401	0.04
Leishmania major	alpha tubulin	0.0018	0.0401	0.5565
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0018	0.0401	0.0346
Entamoeba histolytica	cysteine proteinase, putative	0.0016	0.0338	0.2986
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0024	0.0676	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0024	0.0676	1
Echinococcus multilocularis	hypothetical protein	0.0018	0.0401	0.0346
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0024	0.0676	0.0622
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0024	0.0676	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0024	0.0676	1
Plasmodium vivax	vivapain-2	0.0024	0.0676	0.6564
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0024	0.0676	0.6564
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0174	0.1743
Loa Loa (eye worm)	tubulin alpha 2	0.0014	0.0227	0.2271
Echinococcus granulosus	tubulin alpha 1C chain	0.0018	0.0401	0.0346
Echinococcus multilocularis	tubulin alpha chain	0.0018	0.0401	0.0346
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0024	0.0676	1
Trichomonas vaginalis	tubulin beta chain, putative	0.0018	0.0401	0.5565
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0338	0.3386
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0401	0.4014
Echinococcus multilocularis	tubulin alpha chain	0.0018	0.0401	0.0346
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0024	0.0676	1
Brugia malayi	tubulin alpha chain - mouse	0.0018	0.0401	0.3653
Echinococcus granulosus	tubulin alpha chain	0.0018	0.0401	0.0346
Trypanosoma brucei	alpha tubulin	0.0018	0.0401	0.5565
Echinococcus granulosus	peroxisome assembly protein 26	0.0018	0.0401	0.0346
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0024	0.0676	1
Trichomonas vaginalis	tubulin beta chain, putative	0.0018	0.0401	0.5565
Entamoeba histolytica	cysteine protease, putative	0.0013	0.0181	0.1317
Schistosoma mansoni	tubulin subunit alpha	0.0018	0.0401	0.04
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0016	0.0338	0.455
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0024	0.0676	1
Trichomonas vaginalis	tubulin beta chain, putative	0.0018	0.0401	0.5565
Echinococcus multilocularis	tubulin alpha chain	0.0018	0.0401	0.0346
Echinococcus multilocularis	peroxisome assembly protein 26	0.0018	0.0401	0.0346
Echinococcus multilocularis	cysteine protease	0.0024	0.0676	0.0622
Echinococcus multilocularis	tubulin alpha chain	0.0018	0.0401	0.0346
Echinococcus granulosus	alpha tubulin	0.0018	0.0401	0.0346
Entamoeba histolytica	cysteine protease, putative	0.0013	0.0181	0.1317
Entamoeba histolytica	cysteine proteinase 2	0.0013	0.0181	0.1317
Trypanosoma cruzi	cysteine peptidase, putative	0.0024	0.0676	1
Onchocerca volvulus		0.0024	0.0676	1
Echinococcus granulosus	cathepsin l1	0.0016	0.0338	0.0283
Loa Loa (eye worm)	alpha-tubulin isotype 2	0.0014	0.0227	0.2271
Brugia malayi	Papain family cysteine protease containing protein	0.0013	0.0181	0.1317
Leishmania major	cathepsin L-like protease	0.0024	0.0676	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0024	0.0676	1
Schistosoma mansoni	alpha tubulin	0.0018	0.0401	0.04
Leishmania major	alpha tubulin	0.0018	0.0401	0.5565
Leishmania major	cathepsin L-like protease	0.0024	0.0676	1
Brugia malayi	Cathepsin L-like precursor	0.0016	0.0338	0.2986
Brugia malayi	Tubulin alpha-2 chain	0.0018	0.0401	0.3653
Leishmania major	alpha tubulin	0.0018	0.0401	0.5565
Entamoeba histolytica	cysteine protease, putative	0.0013	0.0181	0.1317
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0024	0.0676	0.6564
Loa Loa (eye worm)	BEN-1 protein	0.001	0.0057	0.057
Echinococcus multilocularis	tubulin subunit TubB	0.0018	0.0401	0.0346
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0018	0.0401	0.0346
Plasmodium vivax	tubulin alpha chain, putative	0.0018	0.0401	0.3653
Giardia lamblia	Alpha-tubulin	0.0018	0.0401	0.3653
Onchocerca volvulus		0.0024	0.0676	1
Entamoeba histolytica	tubulin alpha chain, putative	0.0018	0.0401	0.3653
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0227	0.2271
Schistosoma mansoni	cathepsin F (C01 family)	0.0024	0.0676	0.0719
Entamoeba histolytica	tubulin alpha-1 chain	0.0018	0.0401	0.3653
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0676	0.6759
Echinococcus multilocularis	tubulin alpha chain	0.0018	0.0401	0.0346
Loa Loa (eye worm)	tubulin gamma chain	0.001	0.0057	0.057
Trypanosoma cruzi	cysteine peptidase, putative	0.0024	0.0676	1

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.027 uM	Inhibition of C-terminal His-tagged microtubule-stimulated KSP motor domain (1 to 369) ATPase activity (unknown origin) preincubated for 30 mins followed by ATP addition measured after 15 mins by luciferase-derived luminescence assay	ChEMBL.	24184776
IC50 (functional)	= 4.9 uM	Antiproliferative activity against human HeLa cells after 48 hrs by MTT assay	ChEMBL.	24184776

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	ChEMBL23	24184776

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: CHEMBL3087418

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1843847