TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 391.893 | Formula: C23H22ClN3O
H donors: 2 H acceptors: 1 LogP: 4.91 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: Clc1ccc2c(c1)c1CCN(C(c1[nH]2)c1c[nH]c2c1cccc2)C(=O)C(C)C
InChi: 1S/C23H22ClN3O/c1-13(2)23(28)27-10-9-16-17-11-14(24)7-8-20(17)26-21(16)22(27)18-12-25-19-6-4-3-5-15(18)19/h3-8,11-13,22,25-26H,9-10H2,1-2H3
InChiKey: BXKJAXOAPLWXGB-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
Schistosoma japonicum	ko:K10398 kinesin family member 11, putative	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
Giardia lamblia	Kinesin-5	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
Toxoplasma gondii	kinesin motor domain-containing protein	Get druggable targets OG5_128460	All targets in OG5_128460
Entamoeba histolytica	kinesin, putative	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
Plasmodium falciparum	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
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
Plasmodium knowlesi	kinesin-5, putative	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
Loa Loa (eye worm)	kinesin-like protein KLP2	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
Plasmodium berghei	kinesin-5, putative	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
Cryptosporidium parvum	kinesin-like boursin, 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
Echinococcus multilocularis	kinesin family 1	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
Mycobacterium ulcerans	lipase LipD	0.004	0.0207	0.5
Loa Loa (eye worm)	MH2 domain-containing protein	0.0123	0.2267	0.8214
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0048	0.0395	0.0916
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0042	0.0244	0.0042
Loa Loa (eye worm)	intermediate filament protein	0.0086	0.1342	0.4864
Trypanosoma brucei	FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative	0.006	0.0679	0.185
Trypanosoma cruzi	target of rapamycin kinase 3	0.0114	0.2035	0.7159
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0042	0.0244	0.0042
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0244	0.0885
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0244	0.0885
Brugia malayi	photoreceptor-specific nuclear receptor	0.0042	0.0244	0.0885
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0042	0.0244	0.0244
Loa Loa (eye worm)	hypothetical protein	0.004	0.0207	0.0751
Loa Loa (eye worm)	cytoplasmic intermediate filament protein	0.0046	0.0348	0.1262
Echinococcus granulosus	intermediate filament protein	0.0086	0.1342	0.1297
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0086	0.1328	0.4499
Mycobacterium ulcerans	esterase/lipase LipP	0.004	0.0207	0.5
Echinococcus multilocularis	lamin dm0	0.0086	0.1342	0.1159
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0235	0.085
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0042	0.0244	0.0885
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0042	0.0244	0.0885
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.004	0.0207	0.0751
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	0.0143	0.276	1
Echinococcus multilocularis	FTZ F1 alpha	0.0042	0.0244	0.0038
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0114	0.2026	0.2078
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0042	0.0244	0.0885
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0042	0.0244	0.0244
Schistosoma mansoni	transcription factor LCR-F1	0.0114	0.2026	0.2026
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0042	0.0244	0.0327
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0048	0.0395	0.1431
Brugia malayi	latrophilin 2 splice variant baaae	0.0036	0.0085	0.0309
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0244	0.0885
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0042	0.0244	0.0885
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0244	0.0885
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0042	0.0244	0.0885
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0107	0.1848	0.6498
Echinococcus multilocularis	phosphatidylinositol 3 and 4 kinase	0.0048	0.0395	0.0192
Loa Loa (eye worm)	hypothetical protein	0.004	0.0196	0.0709
Schistosoma mansoni	hypothetical protein	0.0114	0.2026	0.2026
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0143	0.276	1
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0244	0.0885
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0042	0.0244	0.0038
Schistosoma mansoni	thyroid hormone receptor	0.0435	1	1
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.004	0.0207	0.0207
Loa Loa (eye worm)	transcription factor SMAD2	0.0123	0.2267	0.8214
Echinococcus multilocularis	FKBP12 rapamycin complex associated protein	0.0143	0.276	0.2606
Echinococcus granulosus	phosphatidylinositol 3 and 4 kinase	0.0048	0.0395	0.0214
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0042	0.0244	0.0885
Mycobacterium ulcerans	hypothetical protein	0.004	0.0207	0.5
Schistosoma mansoni	lamin	0.0086	0.1342	0.1342
Loa Loa (eye worm)	hypothetical protein	0.004	0.0207	0.0751
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0143	0.276	1
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor2	0.0143	0.276	1
Brugia malayi	nuclear hormone receptor	0.0042	0.0244	0.0885
Schistosoma mansoni	hypothetical protein	0.0036	0.0085	0.0085
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0107	0.1848	0.6498
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0107	0.1848	0.6498
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.004	0.0207	0.0207
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0259	0.5626	1
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0086	0.1342	0.4864
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0077	0.1123	0.3713
Trichomonas vaginalis	esterase, putative	0.004	0.0207	0.0196
Brugia malayi	ecdysteroid receptor	0.0042	0.0244	0.0885
Trichomonas vaginalis	penicillin-binding protein, putative	0.004	0.0207	0.0196
Entamoeba histolytica	phosphatidylinositol3-kinaseTor2, putative	0.0143	0.276	1
Schistosoma mansoni	RAR-like nuclear receptor	0.0042	0.0244	0.0244
Onchocerca volvulus	Bile acid receptor homolog	0.0042	0.0244	0.0327
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0048	0.0395	0.0916
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0052	0.0494	0.1791
Onchocerca volvulus	Protein ultraspiracle homolog	0.0042	0.0244	0.0327
Trypanosoma brucei	target of rapamycin kinase 3, putative	0.0114	0.2035	0.7159
Trichomonas vaginalis	D-aminoacylase, putative	0.004	0.0207	0.0196
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0042	0.0244	0.0244
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0042	0.0244	0.0885
Brugia malayi	beta-lactamase	0.004	0.0207	0.0751
Plasmodium falciparum	kinesin-5	0.0032	0	0.5
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0077	0.1123	0.3713
Brugia malayi	cytoplasmic intermediate filament protein	0.0046	0.0348	0.1262
Mycobacterium leprae	Probable lipase LipE	0.004	0.0207	0.5
Schistosoma mansoni	hypothetical protein	0.0393	0.8957	0.8957
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.2032	0.7204
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.0143	0.276	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0143	0.276	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.2032	0.7204
Entamoeba histolytica	hypothetical protein	0.0114	0.2026	0.7341
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0244	0.0885
Brugia malayi	nuclear receptor NHR-88	0.0042	0.0244	0.0885
Loa Loa (eye worm)	hypothetical protein	0.004	0.0196	0.0709
Loa Loa (eye worm)	steroid hormone receptor	0.0042	0.0244	0.0885
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0042	0.0244	0.0885
Echinococcus multilocularis	ecdysone induced protein 78C	0.0042	0.0244	0.0038
Brugia malayi	Steroid receptor seven-up type 2	0.0042	0.0244	0.0885
Brugia malayi	MH2 domain containing protein	0.0123	0.2267	0.8214
Onchocerca volvulus		0.0086	0.1342	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0077	0.112	0.3702
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0077	0.112	0.3702
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0042	0.0244	0.0038
Onchocerca volvulus		0.0086	0.1342	1
Echinococcus granulosus	FKBP12 rapamycin complex associated protein	0.0143	0.276	0.2917
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0042	0.0244	0.0042
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0042	0.0244	0.0244
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0042	0.0244	0.0244
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0042	0.0244	0.0042
Entamoeba histolytica	hypothetical protein	0.0114	0.2026	0.7341
Trichomonas vaginalis	penicillin-binding protein, putative	0.004	0.0207	0.0196
Echinococcus granulosus	lamin	0.0086	0.1342	0.1297
Echinococcus multilocularis	Mitotic checkpoint protein PRCC, C terminal	0.0393	0.8957	0.8935
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0042	0.0244	0.0038
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0042	0.0244	0.0042
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0042	0.0244	0.0042
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0042	0.0244	0.0885
Echinococcus granulosus	lamin dm0	0.0086	0.1342	0.1297
Echinococcus granulosus	cytoplasmic intermediate filament protein	0.0042	0.0235	0.0032
Loa Loa (eye worm)	phosphatidylinositol 3	0.0048	0.0395	0.1431
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0048	0.0395	0.0916
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0096	0.1588	0.5501
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0114	0.2026	0.1857
Brugia malayi	intermediate filament protein	0.0086	0.1342	0.4864
Leishmania major	phosphatidylinositol 3-related kinase, putative	0.0048	0.0395	0.0735
Entamoeba histolytica	hypothetical protein	0.0114	0.2026	0.7341
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0086	0.1328	0.4499
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.0048	0.0395	0.0735
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0077	0.1123	0.3713
Echinococcus multilocularis	musashi	0.0086	0.1342	0.1159
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0494	0.1791
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0085	0.0309
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0143	0.276	1
Entamoeba histolytica	hypothetical protein	0.0114	0.2026	0.7341
Echinococcus granulosus	Mitotic checkpoint protein PRCC C terminal	0.0393	0.8957	1
Toxoplasma gondii	target of rapamycin (TOR), putative	0.0107	0.1848	1
Toxoplasma gondii	ABC1 family protein	0.004	0.0207	0.1121
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0244	0.0885
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0042	0.0244	0.0885
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0042	0.0244	0.0885
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0122	0.2239	0.8002
Trypanosoma brucei	phosphatidylinositol 3-related kinase, putative	0.0048	0.0395	0.0735
Echinococcus granulosus	kinesin family 1	0.0247	0.5348	0.5875
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0042	0.0244	0.0885
Trichomonas vaginalis	D-aminoacylase, putative	0.004	0.0207	0.0196
Brugia malayi	beta-lactamase family protein	0.004	0.0207	0.0751
Loa Loa (eye worm)	hypothetical protein	0.0085	0.1303	0.4722
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0048	0.0395	0.0916
Onchocerca volvulus		0.0042	0.0244	0.0327
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0042	0.0244	0.0885
Loa Loa (eye worm)	hypothetical protein	0.004	0.0207	0.0751
Leishmania major	phosphatidylinositol 3-kinase, putative	0.0048	0.0395	0.0735
Echinococcus granulosus	FTZ F1 alpha	0.0042	0.0244	0.0042
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0042	0.0244	0.0885
Trypanosoma brucei	phosphatidylinositol 3-kinase tor, putative	0.0068	0.0884	0.2653
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0042	0.0244	0.0042
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0086	0.1328	0.4499
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0042	0.0244	0.0885
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0042	0.0244	0.0885
Leishmania major	target of rapamycin kinase (TOR) kinase 3	0.0114	0.2035	0.7159
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0048	0.0395	0.0916
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0085	0.1307	0.4418
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.2032	0.7204
Brugia malayi	Nuclear hormone receptor-like 1	0.0042	0.0244	0.0885
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0042	0.0244	0.0038
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0093	0.1511	0.5205
Echinococcus granulosus	ecdysone induced protein 78C	0.0042	0.0244	0.0042
Loa Loa (eye worm)	hypothetical protein	0.004	0.0207	0.0751
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0107	0.1848	0.6498
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0077	0.1123	0.3713
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.0048	0.0395	0.0735
Brugia malayi	steroid hormone receptor	0.0042	0.0244	0.0885
Leishmania major	target of rapamycin (TOR) kinase 2, putative	0.0143	0.276	1
Echinococcus multilocularis	kinesin family 1	0.0247	0.5348	0.5249
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0107	0.1848	0.6498
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0042	0.0244	0.0885
Mycobacterium ulcerans	beta-lactamase	0.004	0.0207	0.5
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0052	0.0494	0.1791
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0107	0.1848	0.6498
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0042	0.0244	0.0244
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.004	0.0207	0.5
Schistosoma mansoni	intermediate filament proteins	0.0086	0.1342	0.1342
Schistosoma mansoni	thyroid hormone receptor	0.0435	1	1
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0042	0.0244	0.0038
Entamoeba histolytica	FKBP-rapamycin associated protein (FRAP), putative	0.0143	0.276	1
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.0048	0.0395	0.0735
Schistosoma mansoni	retinoic acid receptor RXR	0.0042	0.0244	0.0244
Trichomonas vaginalis	D-aminoacylase, putative	0.004	0.0207	0.0196
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0042	0.0244	0.0885
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.004	0.0207	0.0751
Brugia malayi	hypothetical protein	0.0114	0.2026	0.7341
Echinococcus multilocularis	lamin	0.0086	0.1342	0.1159
Schistosoma mansoni	nuclear hormone receptor	0.0042	0.0244	0.0244
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0085	0.1307	0.4418
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0052	0.0494	0.1791
Schistosoma mansoni	coup transcription factor	0.0042	0.0244	0.0244
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor1	0.0143	0.276	1
Loa Loa (eye worm)	hypothetical protein	0.004	0.0207	0.0751
Loa Loa (eye worm)	phosphatidylinositol 3	0.0143	0.276	1
Giardia lamblia	GTOR	0.0143	0.276	1
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0042	0.0244	0.0244
Plasmodium vivax	hypothetical protein, conserved	0.004	0.0207	1
Mycobacterium leprae	conserved hypothetical protein	0.004	0.0207	0.5
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0244	0.0885
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.2032	0.7204
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0042	0.0244	0.0885
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0107	0.1848	0.6498
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0042	0.0244	0.0885
Leishmania major	target of rapamycin (TOR) kinase 1, putative	0.0143	0.276	1
Loa Loa (eye worm)	hypothetical protein	0.004	0.0207	0.0751
Echinococcus multilocularis	cytoplasmic intermediate filament protein	0.0042	0.0235	0.0028
Schistosoma mansoni	phosphatidylinositol 3-and 4-kinase	0.0048	0.0395	0.0395
Schistosoma mansoni	ataxia telangiectasia mutated (atm)-related	0.0143	0.276	0.276
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0077	0.112	0.3702
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0042	0.0244	0.0038
Brugia malayi	Intermediate filament tail domain containing protein	0.0086	0.1342	0.4864
Schistosoma mansoni	hypothetical protein	0.0215	0.4549	0.4549
Loa Loa (eye worm)	beta-lactamase	0.004	0.0207	0.0751
Schistosoma mansoni	lamin	0.0086	0.1342	0.1342
Brugia malayi	beta-lactamase family protein	0.004	0.0207	0.0751
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.2032	0.7204
Loa Loa (eye worm)	hypothetical protein	0.0086	0.1342	0.4864

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 1.703 uM	Inhibition of human Eg5 expressed in Escherichia coli assessed as microtubule-activated ATPase activity by spectrophotometry	ChEMBL.	20537544
IC50 (functional)	= 6.83 uM	Antiproliferative activity against human A549 cells after 24 hrs by SRB assay	ChEMBL.	20537544

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	ChEMBL23	20537544

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: CHEMBL1165639

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1146386