TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 524.503 | Formula: C28H21FN6O4
H donors: 2 H acceptors: 5 LogP: 3.33 Rotable bonds: 9
Rule of 5 violations (Lipinski): 2
SMILES: O=C(C1CC1)Nc1cn2c(n1)ccc(n2)Oc1ccc(cc1F)NC(=O)c1cccn(c1=O)c1ccccc1
InChi: 1S/C28H21FN6O4/c29-21-15-18(30-27(37)20-7-4-14-34(28(20)38)19-5-2-1-3-6-19)10-11-22(21)39-25-13-12-24-31-23(16-35(24)33-25)32-26(36)17-8-9-17/h1-7,10-17H,8-9H2,(H,30,37)(H,32,36)
InChiKey: GVVAOKGDOGVPSI-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	kinase insert domain receptor	Starlite/ChEMBL	References
Homo sapiens	MET proto-oncogene, receptor tyrosine kinase	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Loa Loa (eye worm)	TK/KIN16 protein kinase	Get druggable targets OG5_130320	All targets in OG5_130320
Onchocerca volvulus		Get druggable targets OG5_130320	All targets in OG5_130320
Brugia malayi	Immunoglobulin I-set domain containing protein	Get druggable targets OG5_130320	All targets in OG5_130320
Onchocerca volvulus	Tyrosine kinase homolog	Get druggable targets OG5_130320	All targets in OG5_130320

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 beta chain, putative	0.0205	0.7905	0.7363
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0048	0.1473	0.1363
Trypanosoma brucei	beta tubulin	0.0257	1	1
Echinococcus multilocularis	GPCR, family 2	0.0015	0.0127	0.0047
Echinococcus multilocularis	tubulin alpha 3 chain	0.0205	0.7905	0.7888
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0044	0.131	0.131
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0044	0.131	0.131
Echinococcus granulosus	tubulin subunit TubB	0.0205	0.7905	0.7888
Plasmodium falciparum	tubulin epsilon chain, putative	0.0144	0.5383	0.4188
Brugia malayi	Plexin repeat family protein	0.0021	0.0356	0.0233
Loa Loa (eye worm)	cyclic AMP specific phosphodiesterase PDE4D5A	0.0082	0.2854	0.2854
Brugia malayi	N-terminal motif family protein	0.0174	0.6634	0.6591
Trypanosoma brucei	beta tubulin	0.0257	1	1
Echinococcus granulosus	alpha tubulin	0.0205	0.7905	0.7888
Echinococcus granulosus	tubulin alpha 1C chain	0.0205	0.7905	0.7888
Leishmania major	alpha tubulin	0.0205	0.7905	0.7363
Echinococcus granulosus	tubulin alpha 1C chain	0.0205	0.7905	0.7888
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0127	0.0127
Schistosoma mansoni	plexin	0.0021	0.0356	0.0356
Echinococcus multilocularis	Tubulin beta 2C chain	0.0257	1	1
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0061	0.2006	0.2006
Leishmania major	alpha tubulin	0.0205	0.7905	0.7363
Giardia lamblia	Beta tubulin	0.0257	1	1
Loa Loa (eye worm)	TK/EGFR protein kinase	0.0154	0.5793	0.5793
Loa Loa (eye worm)	tubulin alpha 2	0.0062	0.2026	0.2026
Trichomonas vaginalis	tubulin beta chain, putative	0.0205	0.7905	0.7363
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0356	0.0356
Echinococcus multilocularis	Tubulin beta 2C chain	0.0257	1	1
Schistosoma mansoni	alpha tubulin	0.0205	0.7905	0.7905
Echinococcus granulosus	tubulin subunit beta	0.0257	1	1
Wolbachia endosymbiont of Brugia malayi	cell division protein FtsZ	0.0062	0.2056	0.5
Brugia malayi	Tubulin beta chain	0.0062	0.2056	0.1954
Schistosoma mansoni	tubulin subunit alpha	0.0205	0.7905	0.7905
Entamoeba histolytica	tubulin family protein	0.0257	1	1
Schistosoma mansoni	tubulin subunit beta	0.0257	1	1
Plasmodium vivax	tubulin epsilon chain, putative	0.0144	0.5383	0.4188
Brugia malayi	alpha-tubulin	0.0205	0.7905	0.7878
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0015	0.0127	0.0047
Brugia malayi	tubulin alpha chain - mouse	0.0205	0.7905	0.7878
Trichomonas vaginalis	tubulin beta chain, putative	0.0205	0.7905	0.7363
Leishmania major	alpha tubulin	0.0205	0.7905	0.7363
Schistosoma mansoni	tyrosine kinase	0.0081	0.2803	0.2803
Schistosoma mansoni	nephrin	0.0014	0.008	0.008
Entamoeba histolytica	tubulin alpha-1 chain	0.0205	0.7905	0.5463
Echinococcus granulosus	Tubulin beta 2C chain	0.0257	1	1
Leishmania major	gamma-tubulin	0.0144	0.5383	0.4188
Schistosoma mansoni	tubulin subunit beta	0.0062	0.2056	0.2056
Trichomonas vaginalis	tubulin beta chain, putative	0.0205	0.7905	0.7363
Onchocerca volvulus	Rap guanine nucleotide exchange factor 1 homolog	0.0174	0.6634	1
Brugia malayi	Furin-like cysteine rich region family protein	0.0154	0.5793	0.5739
Echinococcus granulosus	beta tubulin	0.0257	1	1
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0044	0.131	0.131
Leishmania major	beta tubulin	0.0257	1	1
Brugia malayi	Tubulin alpha-2 chain	0.0205	0.7905	0.7878
Trypanosoma cruzi	alpha tubulin, putative	0.0205	0.7905	0.7363
Giardia lamblia	Beta tubulin	0.0257	1	1
Echinococcus multilocularis	hypothetical protein	0.0205	0.7905	0.7888
Echinococcus granulosus	melanoma receptor tyrosine protein kinase	0.0084	0.2922	0.2864
Trichomonas vaginalis	tubulin gamma chain, putative	0.0144	0.5383	0.4188
Mycobacterium tuberculosis	Cell division protein FtsZ	0.0062	0.2056	0.5
Mycobacterium leprae	cell division protein FtsZ	0.0062	0.2056	0.5
Plasmodium vivax	tubulin beta chain, putative	0.0257	1	1
Plasmodium falciparum	alpha tubulin 1	0.0205	0.7905	0.7363
Leishmania major	alpha tubulin	0.0205	0.7905	0.7363
Brugia malayi	RNA recognition motif domain containing protein	0.0061	0.2006	0.1903
Echinococcus multilocularis	epidermal growth factor receptor	0.0084	0.2922	0.2864
Schistosoma mansoni	tyrosine kinase	0.0051	0.157	0.157
Loa Loa (eye worm)	tubulin gamma chain	0.0144	0.5383	0.5383
Toxoplasma gondii	alpha-tubulin I, putative	0.0205	0.7905	0.7363
Loa Loa (eye worm)	beta-tubulin	0.0257	1	1
Echinococcus granulosus	peroxisome assembly protein 26	0.0205	0.7905	0.7888
Loa Loa (eye worm)	hypothetical protein	0.0205	0.7905	0.7905
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0113	0.0113
Leishmania major	beta tubulin	0.0257	1	1
Leishmania major	alpha tubulin	0.0205	0.7905	0.7363
Trypanosoma brucei	epsilon tubulin	0.0144	0.5383	0.4188
Entamoeba histolytica	tubulin family protein	0.0257	1	1
Leishmania major	beta tubulin	0.0257	1	1
Echinococcus multilocularis	tubulin alpha chain	0.0205	0.7905	0.7888
Echinococcus granulosus	tubulin alpha 3 chain	0.0205	0.7905	0.7888
Echinococcus multilocularis	tubulin subunit TubB	0.0205	0.7905	0.7888
Echinococcus multilocularis	beta tubulin	0.0257	1	1
Trichomonas vaginalis	tubulin, putative	0.0081	0.283	0.0974
Onchocerca volvulus		0.0081	0.283	0.3941
Leishmania major	beta tubulin	0.0257	1	1
Trypanosoma brucei	beta tubulin	0.0144	0.5383	0.4188
Echinococcus granulosus	insulin receptor	0.0051	0.157	0.1502
Schistosoma mansoni	tyrosine kinase	0.0051	0.157	0.157
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0205	0.7905	0.7888
Echinococcus multilocularis	cAMP specific 3',5' cyclic phosphodiesterase	0.0093	0.3318	0.3264
Schistosoma mansoni	tar DNA-binding protein	0.0061	0.2006	0.2006
Echinococcus multilocularis	tubulin, beta 4A class IVa	0.0257	1	1
Leishmania major	alpha tubulin	0.0205	0.7905	0.7363
Echinococcus multilocularis	tar DNA binding protein	0.0061	0.2006	0.1941
Loa Loa (eye worm)	tubulin alpha-2 chain	0.0205	0.7905	0.7905
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0048	0.1473	0.1473
Loa Loa (eye worm)	tubulin alpha 2	0.0143	0.5352	0.5352
Schistosoma mansoni	camp-specific 35-cyclic phosphodiesterase	0.0093	0.3318	0.3318
Loa Loa (eye worm)	tubulin beta-1 chain	0.0257	1	1
Echinococcus granulosus	tubulin alpha 3 chain	0.0205	0.7905	0.7888
Leishmania major	beta tubulin	0.0257	1	1
Brugia malayi	Tubulin beta chain	0.0081	0.283	0.2738
Schistosoma mansoni	hypothetical protein	0.0015	0.0127	0.0127
Entamoeba histolytica	tubulin alpha chain, putative	0.0205	0.7905	0.5463
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0143	0.5352	0.4149
Leishmania major	beta tubulin	0.0257	1	1
Trichomonas vaginalis	tubulin, putative	0.0081	0.283	0.0974
Trypanosoma brucei	alpha tubulin, putative	0.0081	0.283	0.0974
Loa Loa (eye worm)	hypothetical protein	0.0033	0.085	0.085
Echinococcus granulosus	tubulin epsilon chain	0.0144	0.5383	0.5345
Echinococcus granulosus	cAMP specific 3'5' cyclic phosphodiesterase	0.0082	0.2854	0.2796
Loa Loa (eye worm)	RNA binding protein	0.0061	0.2006	0.2006
Echinococcus multilocularis	tubulin subunit beta	0.0257	1	1
Schistosoma mansoni	hypothetical protein	0.0015	0.0127	0.0127
Echinococcus multilocularis	tubulin alpha chain	0.0205	0.7905	0.7888
Giardia lamblia	Alpha-tubulin	0.0205	0.7905	0.7363
Brugia malayi	Probable 3',5'-cyclic phosphodiesterase R153.1, putative	0.0082	0.2854	0.2762
Loa Loa (eye worm)	hypothetical protein	0.0093	0.3318	0.3318
Schistosoma mansoni	tyrosine kinase	0.0084	0.2922	0.2922
Leishmania major	beta tubulin	0.0257	1	1
Plasmodium vivax	tubulin alpha chain, putative	0.0205	0.7905	0.7363
Echinococcus multilocularis	tubulin alpha 1C chain	0.0205	0.7905	0.7888
Schistosoma mansoni	tar DNA-binding protein	0.0061	0.2006	0.2006
Echinococcus granulosus	Tubulin beta 2C chain	0.0257	1	1
Echinococcus granulosus	tubulin alpha chain	0.0205	0.7905	0.7888
Loa Loa (eye worm)	tubulin alpha chain	0.0205	0.7905	0.7905
Echinococcus granulosus	Tubulin alpha 1 chain	0.0205	0.7905	0.7888
Schistosoma mansoni	tubulin subunit beta	0.0257	1	1
Leishmania major	beta tubulin	0.0257	1	1
Loa Loa (eye worm)	tubulin alpha chain	0.0205	0.7905	0.7905
Schistosoma mansoni	tubulin subunit beta	0.0257	1	1
Echinococcus multilocularis	plexin a4	0.0025	0.0512	0.0436
Schistosoma mansoni	tubulin subunit epsilon	0.0144	0.5383	0.5383
Treponema pallidum	cell division protein FtsZ	0.0062	0.2056	0.5
Trypanosoma cruzi	beta tubulin, putative	0.0257	1	1
Loa Loa (eye worm)	alpha-tubulin	0.0205	0.7905	0.7905
Echinococcus granulosus	tubulin alpha chain	0.0205	0.7905	0.7888
Schistosoma mansoni	hypothetical protein	0.0015	0.0127	0.0127
Echinococcus granulosus	tubulin alpha chain	0.0205	0.7905	0.7888
Brugia malayi	tubulin alpha-2 chain	0.0205	0.7905	0.7878
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0015	0.0127	0.0127
Echinococcus granulosus	insulin growth factor 1 receptor beta	0.0051	0.157	0.1502
Trichomonas vaginalis	tubulin beta chain, putative	0.0257	1	1
Schistosoma mansoni	tyrosine kinase	0.0084	0.2922	0.2922
Schistosoma mansoni	tar DNA-binding protein	0.0061	0.2006	0.2006
Loa Loa (eye worm)	tubulin beta-4 chain	0.0257	1	1
Loa Loa (eye worm)	hypothetical protein	0.0018	0.023	0.023
Toxoplasma gondii	beta tubulin	0.0257	1	1
Echinococcus multilocularis	tubulin epsilon chain	0.0144	0.5383	0.5345
Loa Loa (eye worm)	alpha-tubulin isotype 2	0.0143	0.5352	0.5352
Brugia malayi	Cell division protein ftsZ	0.0062	0.2056	0.1954
Echinococcus multilocularis	Tubulin beta 2C chain	0.0257	1	1
Schistosoma mansoni	tyrosine kinase	0.0081	0.2803	0.2803
Echinococcus multilocularis	tubulin alpha chain	0.0205	0.7905	0.7888
Leishmania major	beta tubulin	0.0257	1	1
Echinococcus granulosus	epidermal growth factor receptor	0.0154	0.5793	0.5759
Trichomonas vaginalis	tubulin alpha chain, putative	0.0081	0.283	0.0974
Leishmania major	alpha tubulin	0.0205	0.7905	0.7363
Leishmania major	alpha tubulin	0.0205	0.7905	0.7363
Echinococcus multilocularis	beta tubulin	0.0257	1	1
Leishmania major	alpha tubulin	0.0205	0.7905	0.7363
Leishmania major	beta tubulin	0.0257	1	1
Trypanosoma brucei	beta tubulin	0.0257	1	1
Schistosoma mansoni	tubulin subunit alpha	0.0205	0.7905	0.7905
Echinococcus granulosus	tubulin gamma 1 chain	0.0144	0.5383	0.5345
Echinococcus multilocularis	tubulin alpha 3 chain	0.0205	0.7905	0.7888
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0015	0.0127	0.0047
Schistosoma mansoni	alpha tubulin	0.0205	0.7905	0.7905
Leishmania major	alpha tubulin	0.0205	0.7905	0.7363
Trichomonas vaginalis	tubulin alpha chain, putative	0.0257	1	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0044	0.131	0.124
Echinococcus multilocularis	tubulin gamma 1 chain	0.0144	0.5383	0.5345
Brugia malayi	plexin A	0.0025	0.0512	0.0391
Echinococcus multilocularis	tubulin beta 1 chain	0.0257	1	1
Trypanosoma brucei	epsilon tubulin	0.0144	0.5383	0.4188
Toxoplasma gondii	tubulin/FtsZ family, GTPase domain-containing protein	0.0144	0.5383	0.4188
Schistosoma mansoni	tubulin subunit gamma	0.0144	0.5383	0.5383
Loa Loa (eye worm)	hypothetical protein	0.0018	0.023	0.023
Loa Loa (eye worm)	BEN-1 protein	0.0257	1	1
Echinococcus multilocularis	tubulin alpha	0.0144	0.5383	0.5345
Giardia lamblia	Beta tubulin	0.0257	1	1
Toxoplasma gondii	beta-tubulin, putative	0.0257	1	1
Leishmania major	alpha tubulin	0.0205	0.7905	0.7363
Leishmania major	beta tubulin	0.0257	1	1
Trypanosoma brucei	alpha tubulin	0.0205	0.7905	0.7363
Echinococcus granulosus	tubulin alpha chain	0.0205	0.7905	0.7888
Echinococcus granulosus	Tubulin alpha 1 chain	0.0205	0.7905	0.7888
Echinococcus multilocularis	insulin receptor	0.0051	0.157	0.1502
Trypanosoma brucei	alpha tubulin	0.0205	0.7905	0.7363
Echinococcus granulosus	epidermal growth factor receptor	0.0084	0.2922	0.2864
Loa Loa (eye worm)	TK/INSR protein kinase	0.0051	0.157	0.157
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0184	0.7045	0.7008
Leishmania major	beta tubulin	0.0257	1	1
Echinococcus granulosus	neurotracting:lsamp:neurotrimin:obcam	0.0015	0.0113	0.0033
Schistosoma mansoni	cell adhesion molecule	0.0015	0.0113	0.0113
Trichomonas vaginalis	tubulin beta chain, putative	0.0205	0.7905	0.7363
Toxoplasma gondii	beta-1 tubulin, putative	0.0257	1	1
Loa Loa (eye worm)	tubulin beta-2A chain	0.0257	1	1
Schistosoma mansoni	alpha tubulin	0.0205	0.7905	0.7905
Trichomonas vaginalis	tubulin alpha chain, putative	0.0081	0.283	0.0974
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0015	0.0127	0.0047
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0044	0.131	0.124
Loa Loa (eye worm)	tubulin beta chain	0.0257	1	1
Echinococcus granulosus	Tubulin beta 2C chain	0.0257	1	1
Schistosoma mansoni	hypothetical protein	0.0015	0.0127	0.0127
Giardia lamblia	CAMP-specific 3,5-cyclic phosphodiesterase 4B	0.0093	0.3318	0.1588
Plasmodium falciparum	alpha tubulin 2	0.0205	0.7905	0.7363
Echinococcus multilocularis	tubulin alpha chain	0.0205	0.7905	0.7888
Brugia malayi	RNA binding protein	0.0061	0.2006	0.1903
Echinococcus multilocularis	Tubulin beta 2C chain	0.0257	1	1
Loa Loa (eye worm)	hypothetical protein	0.0174	0.6634	0.6634
Trichomonas vaginalis	tubulin, putative	0.0257	1	1
Loa Loa (eye worm)	TAR-binding protein	0.0061	0.2006	0.2006
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0257	1	1
Echinococcus granulosus	plexin a4	0.0025	0.0512	0.0436
Echinococcus granulosus	cAMP specific 3'5' cyclic phosphodiesterase	0.0093	0.3318	0.3264
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0044	0.131	0.124
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0205	0.7905	0.7888
Echinococcus multilocularis	cAMP specific 3',5' cyclic phosphodiesterase	0.0093	0.3318	0.3264
Leishmania major	beta tubulin	0.0257	1	1
Loa Loa (eye worm)	alpha-tubulin	0.0205	0.7905	0.7905
Echinococcus multilocularis	peroxisome assembly protein 26	0.0205	0.7905	0.7888
Schistosoma mansoni	tubulin subunit beta	0.0257	1	1
Brugia malayi	beta-tubulin, identical	0.0257	1	1
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0044	0.131	0.1199
Brugia malayi	Tubulin alpha chain	0.0205	0.7905	0.7878
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0093	0.3318	0.1588
Trypanosoma cruzi	tubulin gamma chain	0.0144	0.5383	0.4188
Onchocerca volvulus		0.0167	0.6318	0.9496
Echinococcus granulosus	tubulin beta 1 chain	0.0257	1	1
Echinococcus multilocularis		0.0047	0.1424	0.1355
Loa Loa (eye worm)	plexin A	0.0025	0.0512	0.0512
Schistosoma mansoni	tar DNA-binding protein	0.0061	0.2006	0.2006
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0205	0.7905	0.7888
Plasmodium falciparum	tubulin gamma chain	0.0144	0.5383	0.4188
Brugia malayi	Tubulin alpha-2 chain	0.0205	0.7905	0.7878
Mycobacterium ulcerans	cell division protein FtsZ	0.0062	0.2056	0.5
Trichomonas vaginalis	tubulin alpha chain, putative	0.0081	0.283	0.0974
Loa Loa (eye worm)	BEN-1 protein	0.0257	1	1
Toxoplasma gondii	alpha tubulin TUBA1	0.0205	0.7905	0.7363
Plasmodium vivax	tubulin gamma chain, putative	0.0144	0.5383	0.4188
Loa Loa (eye worm)	tubulin alpha 2	0.0143	0.5352	0.5352
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0205	0.7905	0.7363
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0015	0.0127	0.0047
Schistosoma mansoni	tubulin subunit alpha	0.0062	0.2056	0.2056
Loa Loa (eye worm)	TK/KIN16 protein kinase	0.0184	0.7045	0.7045
Loa Loa (eye worm)	tubulin alpha-3 chain	0.0124	0.4578	0.4578
Giardia lamblia	Gamma tubulin	0.0144	0.5383	0.4188
Echinococcus granulosus	roundabout 2	0.0018	0.023	0.0151
Brugia malayi	Protein kinase domain containing protein	0.0051	0.157	0.1462
Plasmodium falciparum	tubulin beta chain	0.0257	1	1
Schistosoma mansoni	tubulin subunit alpha	0.0205	0.7905	0.7905
Trichomonas vaginalis	tubulin beta chain, putative	0.0081	0.283	0.0974
Echinococcus granulosus	tubulin beta 4A class IVa	0.0257	1	1
Schistosoma mansoni	tubulin subunit delta	0.0062	0.2056	0.2056
Trichomonas vaginalis	tubulin gamma chain, putative	0.0144	0.5383	0.4188
Onchocerca volvulus	Tyrosine kinase homolog	0.0172	0.6554	0.9872
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0205	0.7905	0.7363
Echinococcus granulosus	Tubulin beta 2C chain	0.0257	1	1
Echinococcus multilocularis	tubulin alpha 1C chain	0.0205	0.7905	0.7888
Trypanosoma brucei	tubulin gamma chain	0.0144	0.5383	0.4188
Leishmania major	beta tubulin	0.0257	1	1
Echinococcus multilocularis	tubulin delta chain	0.0062	0.2056	0.1992
Trichomonas vaginalis	tubulin alpha chain, putative	0.0144	0.5383	0.4188
Loa Loa (eye worm)	tubulin beta chain	0.0062	0.2056	0.2056
Loa Loa (eye worm)	hypothetical protein	0.0048	0.1473	0.1473
Trypanosoma brucei	alpha tubulin	0.0205	0.7905	0.7363
Trypanosoma brucei	epsilon tubulin	0.0144	0.5383	0.4188
Brugia malayi	Tubulin alpha chain	0.0062	0.2056	0.1954
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0044	0.131	0.124
Giardia lamblia	Alpha-tubulin	0.0205	0.7905	0.7363
Schistosoma mansoni	tyrosine kinase	0.0081	0.2803	0.2803
Echinococcus multilocularis	epidermal growth factor receptor	0.0154	0.5793	0.5759
Echinococcus granulosus	GPCR family 2	0.0015	0.0127	0.0047
Echinococcus multilocularis	cAMP specific 3',5' cyclic phosphodiesterase	0.0082	0.2854	0.2796
Leishmania major	beta tubulin	0.0257	1	1
Schistosoma mansoni	hypothetical protein	0.0033	0.085	0.085
Schistosoma mansoni	tubulin subunit beta	0.0257	1	1
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0205	0.7905	0.7363
Trypanosoma brucei	alpha tubulin	0.0205	0.7905	0.7363
Echinococcus multilocularis	tubulin alpha chain	0.0205	0.7905	0.7888
Trichomonas vaginalis	tubulin beta chain, putative	0.0205	0.7905	0.7363
Leishmania major	epsilon tubulin, putative	0.0144	0.5383	0.4188
Trypanosoma brucei	beta tubulin	0.0257	1	1
Brugia malayi	Tubulin gamma chain	0.0144	0.5383	0.5324
Loa Loa (eye worm)	hypothetical protein	0.0124	0.4578	0.4578
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0048	0.1473	0.1363
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0124	0.4578	0.3175
Echinococcus granulosus	tubulin delta chain	0.0062	0.2056	0.1992
Leishmania major	beta tubulin	0.0257	1	1
Schistosoma mansoni	tyrosine kinase	0.0154	0.5793	0.5793
Loa Loa (eye worm)	hypothetical protein	0.0143	0.5352	0.5352
Echinococcus granulosus	beta tubulin	0.0257	1	1
Brugia malayi	latrophilin 2 splice variant baaae	0.0033	0.085	0.0732
Echinococcus granulosus	tubulin alpha chain	0.0205	0.7905	0.7888
Echinococcus multilocularis	Tubulin beta 2C chain	0.0257	1	1
Brugia malayi	TAR-binding protein	0.0061	0.2006	0.1903
Leishmania major	beta tubulin	0.0257	1	1
Echinococcus granulosus	tubulin alpha	0.0144	0.5383	0.5345
Echinococcus granulosus	Tubulin beta 2C chain	0.0257	1	1
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0257	1	1
Leishmania major	beta tubulin	0.0257	1	1
Echinococcus granulosus	cAMP specific 3'5' cyclic phosphodiesterase	0.0093	0.3318	0.3264
Echinococcus multilocularis	roundabout 2	0.0018	0.023	0.0151
Echinococcus granulosus	Tubulin alpha 1 chain	0.0205	0.7905	0.7888
Schistosoma mansoni	tar DNA-binding protein	0.0061	0.2006	0.2006
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0044	0.131	0.131
Echinococcus multilocularis	insulin growth factor 1 receptor beta	0.0051	0.157	0.1502
Trichomonas vaginalis	tubulin gamma chain, putative	0.0257	1	1
Trypanosoma cruzi	epsilon tubulin, putative	0.0144	0.5383	0.4188
Trypanosoma cruzi	epsilon tubulin, putative	0.0144	0.5383	0.4188
Leishmania major	alpha tubulin	0.0205	0.7905	0.7363
Schistosoma mansoni	tubulin subunit beta	0.0257	1	1
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0081	0.283	0.0974
Echinococcus granulosus	tar DNA binding protein	0.0061	0.2006	0.1941
Plasmodium vivax	tubulin alpha chain, putative	0.0205	0.7905	0.7363

Activities

Activity type	Activity value	Assay description	Source	Reference
CL (ADMET)	= 3 microL/min/mg	Clearance in human liver microsomes at 1 umol/L by HPLC analysis	ChEMBL.	24216091
IC50 (binding)	= 0.42 nM	Inhibition of N-terminal FLAG-tagged VEGFR2 cytoplasmic domain (790 to 1356) (unknown origin) expressed in baculovirus expression system using biotinylated poly-GluTyr (4:1) as substrate preincubated for 60 mins followed by 1000 uM of ATP addition measured after 10 mins by AlphaScreen assay	ChEMBL.	24216091
IC50 (binding)	= 1.7 nM	Inhibition of c-Met (unknown origin) using biotinylated poly-GluTyr (4:1) as substrate preincubated for 5 mins followed by 2 uM of ATP addition measured after 20 mins by AlphaScreen assay	ChEMBL.	24216091
IC50 (binding)	= 2.5 nM	Inhibition of N-terminal FLAG-tagged VEGFR2 cytoplasmic domain (790 to 1356) (unknown origin) expressed in baculovirus expression system using biotinylated poly-GluTyr (4:1) as substrate preincubated for 5 mins followed by 10 uM of ATP addition measured after 10 mins by AlphaScreen assay	ChEMBL.	24216091
IC50 (binding)	= 4 nM	Inhibition of c-Met (unknown origin) using biotinylated poly-GluTyr (4:1) as substrate preincubated for 60 mins followed by 1000 uM of ATP addition measured after 20 mins by AlphaScreen assay	ChEMBL.	24216091
IC50 (binding)	= 5.2 nM	Inhibition of N-terminal FLAG-tagged VEGFR2 cytoplasmic domain (790 to 1356) (unknown origin) expressed in baculovirus expression system using biotinylated poly-GluTyr (4:1) as substrate preincubated for 5 mins followed by 1000 uM of ATP addition measured after 10 mins by AlphaScreen assay	ChEMBL.	24216091
IC50 (functional)	= 7 nM	Cytotoxicity against VEGF-stimulated HUVEC assessed as growth inhibition after 120 hrs by CCK-8 assay	ChEMBL.	24216091
IC50 (binding)	= 26 nM	Inhibition of c-Met (unknown origin) using biotinylated poly-GluTyr (4:1) as substrate preincubated for 5 mins followed by 1000 uM of ATP addition measured after 20 mins by AlphaScreen assay	ChEMBL.	24216091
Inhibition (binding)		Inhibition of c-Met (unknown origin) using biotinylated poly-GluTyr (4:1) as substrate by AlphaScreen assay in presence of 1000 uM of ATP	ChEMBL.	24216091

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	ChEMBL23	24216091

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: CHEMBL3093583

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1829966