TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 530.016 | Formula: C26H32ClN5O5
H donors: 1 H acceptors: 3 LogP: 3.98 Rotable bonds: 10
Rule of 5 violations (Lipinski): 2
SMILES: COc1ccc(c(n1)Nc1ncnc2c1c(OC1CCOCC1)cc(c2)OCCCN1CCOCC1)Cl
InChi: 1S/C26H32ClN5O5/c1-33-23-4-3-20(27)25(30-23)31-26-24-21(28-17-29-26)15-19(16-22(24)37-18-5-11-34-12-6-18)36-10-2-7-32-8-13-35-14-9-32/h3-4,15-18H,2,5-14H2,1H3,(H,28,29,30,31)
InChiKey: DRRPOWMBNXYOQX-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	SRC proto-oncogene, non-receptor tyrosine kinase	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Echinococcus granulosus	tyrosine protein kinase Src64B	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus multilocularis	tyrosine protein kinase HCK	Get druggable targets OG5_127750	All targets in OG5_127750
Entamoeba histolytica	protein kinase, putative	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus multilocularis	tyrosine protein kinase Fyn	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus granulosus	proto oncogene tyrosine protein kinase LCK	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus multilocularis	tyrosine protein kinase Blk	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus multilocularis	tyrosine protein kinase Fyn	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus granulosus	3'partial\|tyrosine protein kinase Fgr	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus granulosus	tyrosine protein kinase Src42A	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus multilocularis	tyrosine protein kinase Fyn	Get druggable targets OG5_127750	All targets in OG5_127750
Loa Loa (eye worm)	TK protein kinase	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus granulosus	tyrosine kinase	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus multilocularis	tyrosine protein kinase Srms	Get druggable targets OG5_127750	All targets in OG5_127750
Schistosoma japonicum	ko:K08892 fyn-related kinase, putative	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus granulosus	tyrosine protein kinase Src42A	Get druggable targets OG5_127750	All targets in OG5_127750
Loa Loa (eye worm)	SRC-1	Get druggable targets OG5_127750	All targets in OG5_127750
Onchocerca volvulus	Tyrosine kinase homolog	Get druggable targets OG5_130320	All targets in OG5_130320
Schistosoma mansoni	tyrosine kinase	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus granulosus	tyrosine kinase\|tyrosine protein kinase Fyn	Get druggable targets OG5_127750	All targets in OG5_127750
Schistosoma japonicum	Proto-oncogene tyrosine-protein kinase FYN, putative	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus multilocularis	tyrosine protein kinase lyn tyrosine protein kinase blk	Get druggable targets OG5_127750	All targets in OG5_127750
Schistosoma japonicum	Proto-oncogene tyrosine-protein kinase FYN, putative	Get druggable targets OG5_127750	All targets in OG5_127750
Loa Loa (eye worm)	TK/KIN16 protein kinase	Get druggable targets OG5_130320	All targets in OG5_130320
Schistosoma japonicum	Proto-oncogene tyrosine-protein kinase FGR, putative	Get druggable targets OG5_127750	All targets in OG5_127750
Brugia malayi	protein-tyrosine kinase	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus multilocularis	tyrosine protein kinase Fyn	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus multilocularis	tyrosine protein kinase Src64B	Get druggable targets OG5_127750	All targets in OG5_127750
Brugia malayi	Immunoglobulin I-set domain containing protein	Get druggable targets OG5_130320	All targets in OG5_130320
Echinococcus granulosus	tyrosine protein kinase Lyn	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus multilocularis	tyrosine protein kinase Src42A	Get druggable targets OG5_127750	All targets in OG5_127750
Loa Loa (eye worm)	TK protein kinase	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus granulosus	tyrosine protein kinase Fyn	Get druggable targets OG5_127750	All targets in OG5_127750
Schistosoma mansoni	tyrosine kinase	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus granulosus	tyrosine protein kinase HCK	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus multilocularis	proto oncogene tyrosine protein kinase LCK	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus granulosus	tyrosine protein kinase Blk	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus multilocularis	tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase	Get druggable targets OG5_127750	All targets in OG5_127750
Onchocerca volvulus		Get druggable targets OG5_130320	All targets in OG5_130320
Echinococcus multilocularis	tyrosine protein kinase Src42A	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus multilocularis	tyrosine protein kinase Fgr	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus granulosus	tyrosine protein kinase Fyn	Get druggable targets OG5_127750	All targets in OG5_127750
Schistosoma japonicum	ko:K05703 proto-oncogene tyrosine-protein kinase Fyn, putative	Get druggable targets OG5_127750	All targets in OG5_127750
Schistosoma japonicum	Proto-oncogene tyrosine-protein kinase Yrk, putative	Get druggable targets OG5_127750	All targets in OG5_127750
Brugia malayi	SRC-1	Get druggable targets OG5_127750	All targets in OG5_127750
Echinococcus granulosus	tyrosine protein kinase Fyn	Get druggable targets OG5_127750	All targets in OG5_127750

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
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0101	0.0129
Trichomonas vaginalis	modulator of drug activity B, putative	0.0062	0.222	0.1758
Echinococcus granulosus	proto oncogene tyrosine protein kinase LCK	0.0046	0.1583	0.6819
Echinococcus multilocularis	dihydrolipoamide dehydrogenase	0.0022	0.0561	0.2399
Trichomonas vaginalis	conserved hypothetical protein	0.0247	1	1
Echinococcus multilocularis	neuroglian	0.0014	0.0222	0.0932
Loa Loa (eye worm)	TK protein kinase	0.0038	0.1205	0.1631
Trichomonas vaginalis	conserved hypothetical protein	0.0247	1	1
Trichomonas vaginalis	modulator of drug activity B, putative	0.0062	0.222	0.1758
Trichomonas vaginalis	conserved hypothetical protein	0.0247	1	1
Trichomonas vaginalis	NAD(P)H dehydrogenase, putative	0.0247	1	1
Echinococcus granulosus	Immunoglobulin	0.0011	0.0101	0.041
Trichomonas vaginalis	modulator of drug activity B, putative	0.0062	0.222	0.1758
Echinococcus granulosus	tyrosine protein kinase HCK	0.0038	0.1205	0.5187
Trichomonas vaginalis	NAD(P)H dehydrogenase, putative	0.0247	1	1
Entamoeba histolytica	iron-sulfur flavoprotein, putative	0.0062	0.222	1
Echinococcus granulosus	3'partial\|tyrosine protein kinase Fgr	0.0046	0.1583	0.6819
Echinococcus granulosus	tyrosine protein kinase Fyn	0.0046	0.1583	0.6819
Loa Loa (eye worm)	SRC-1	0.0046	0.1583	0.2145
Echinococcus granulosus	defective proboscis extension response	0.0011	0.0101	0.041
Brugia malayi	SRC-1	0.0046	0.1583	0.2145
Trichomonas vaginalis	modulator of drug activity B, putative	0.0062	0.222	0.1758
Trichomonas vaginalis	modulator of drug activity B, putative	0.0062	0.222	0.1758
Schistosoma mansoni	Neurotrimin precursor (hNT)	0.0011	0.0101	0.0436
Treponema pallidum	NADH oxidase	0.0022	0.0561	0.5
Echinococcus granulosus	tyrosine protein kinase Src42A	0.004	0.13	0.5595
Schistosoma mansoni	tyrosine kinase	0.0011	0.0103	0.0443
Trichomonas vaginalis	conserved hypothetical protein	0.0247	1	1
Echinococcus granulosus	c src tyrosine kinase	0.0011	0.0103	0.0418
Plasmodium vivax	thioredoxin reductase, putative	0.0064	0.2318	1
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0011	0.0101	0.0129
Schistosoma mansoni	growth factor receptor-bound protein	0.0009	0.0006	0.0027
Echinococcus multilocularis	tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase	0.0046	0.1583	0.6819
Echinococcus granulosus	tyrosine protein kinase Fyn	0.0046	0.1583	0.6819
Trichomonas vaginalis	conserved hypothetical protein	0.0062	0.222	0.1758
Giardia lamblia	NADPH oxidoreductase, putative	0.0247	1	1
Plasmodium falciparum	glutathione reductase	0.0064	0.2318	1
Onchocerca volvulus	Tyrosine kinase homolog	0.0172	0.685	1
Trichomonas vaginalis	NAD(P)H dehydrogenase, putative	0.0062	0.222	0.1758
Echinococcus granulosus	tyrosine kinase\|tyrosine protein kinase Fyn	0.0042	0.1396	0.6013
Trichomonas vaginalis	modulator of drug activity B, putative	0.0062	0.222	0.1758
Toxoplasma gondii	thioredoxin reductase	0.0064	0.2318	1
Schistosoma mansoni	nck2/grb4	0.0009	0.0006	0.0027
Trichomonas vaginalis	conserved hypothetical protein	0.0247	1	1
Trypanosoma brucei	trypanothione reductase	0.0064	0.2318	1
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0184	0.7356	1
Echinococcus multilocularis	tyrosine protein kinase HCK	0.0038	0.1205	0.5187
Trichomonas vaginalis	conserved hypothetical protein	0.0062	0.222	0.1758
Trichomonas vaginalis	modulator of drug activity B, putative	0.0062	0.222	0.1758
Trichomonas vaginalis	conserved hypothetical protein	0.0247	1	1
Chlamydia trachomatis	dihydrolipoyl dehydrogenase	0.0022	0.0561	0.5
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0101	0.0129
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0046	0.1583	0.6819
Schistosoma mansoni	proto-oncogene tyrosine-protein kinase abl1	0.0009	0.0006	0.0027
Echinococcus granulosus	roundabout 2	0.0018	0.0376	0.1598
Echinococcus granulosus	tyrosine protein kinase Blk	0.0042	0.1396	0.6013
Leishmania major	trypanothione reductase	0.0064	0.2318	1
Echinococcus multilocularis	Immunoglobulin	0.0011	0.0101	0.041
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0101	0.0129
Brugia malayi	Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein	0.0016	0.0313	0.0418
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0064	0.2318	1
Trichomonas vaginalis	modulator of drug activity B, putative	0.0062	0.222	0.1758
Echinococcus multilocularis	tyrosine protein kinase Src42A	0.0046	0.1583	0.6819
Echinococcus multilocularis	tyrosine protein kinase lyn tyrosine protein kinase blk	0.0046	0.1583	0.6819
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0064	0.2318	1
Schistosoma mansoni	dihydrolipoamide dehydrogenase	0.0022	0.0561	0.2419
Trichomonas vaginalis	modulator of drug activity B, putative	0.0062	0.222	0.1758
Brugia malayi	dihydrolipoyl dehydrogenase, mitochondrial precursor, putative	0.0022	0.0561	0.0754
Echinococcus multilocularis	tyrosine protein kinase Fgr	0.0046	0.1583	0.6819
Trichomonas vaginalis	conserved hypothetical protein	0.0247	1	1
Entamoeba histolytica	hypothetical protein	0.0062	0.222	1
Trichomonas vaginalis	modulator of drug activity B, putative	0.0062	0.222	0.1758
Plasmodium vivax	glutathione reductase, putative	0.0064	0.2318	1
Trichomonas vaginalis	conserved hypothetical protein	0.0062	0.222	0.1758
Echinococcus granulosus	tyrosine protein kinase Btk29A	0.0011	0.0103	0.0418
Trichomonas vaginalis	modulator of drug activity B, putative	0.0062	0.222	0.1758
Trichomonas vaginalis	conserved hypothetical protein	0.0062	0.222	0.1758
Giardia lamblia	NADPH oxidoreductase, putative	0.0247	1	1
Echinococcus multilocularis	c src tyrosine kinase	0.0011	0.0103	0.0418
Echinococcus multilocularis	tyrosine protein kinase Blk	0.0042	0.1396	0.6013
Echinococcus multilocularis	tyrosine protein kinase Abl	0.0011	0.0103	0.0418
Echinococcus granulosus	neurotracting:lsamp:neurotrimin:obcam	0.0015	0.0255	0.1076
Schistosoma mansoni	adapter molecule crk	0.0009	0.0006	0.0027
Trichomonas vaginalis	conserved hypothetical protein	0.0062	0.222	0.1758
Schistosoma mansoni	nephrin	0.0014	0.0222	0.0957
Loa Loa (eye worm)	glutathione reductase	0.0064	0.2318	0.3145
Echinococcus multilocularis	tyrosine protein kinase Src64B	0.0046	0.1583	0.6819
Trichomonas vaginalis	modulator of drug activity B, putative	0.0062	0.222	0.1758
Mycobacterium ulcerans	dihydrolipoamide dehydrogenase	0.0022	0.0561	0.5
Trichomonas vaginalis	modulator of drug activity B, putative	0.0062	0.222	0.1758
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0101	0.0129
Trichomonas vaginalis	modulator of drug activity B, putative	0.0062	0.222	0.1758
Schistosoma mansoni	growth factor receptor-bound protein	0.0009	0.0006	0.0027
Loa Loa (eye worm)	thioredoxin reductase	0.0064	0.2318	0.3145
Trichomonas vaginalis	modulator of drug activity B, putative	0.0062	0.222	0.1758
Brugia malayi	Thioredoxin reductase	0.0064	0.2318	0.3145
Echinococcus granulosus	twitchin	0.0014	0.0222	0.0932
Trichomonas vaginalis	conserved hypothetical protein	0.0247	1	1
Trichomonas vaginalis	modulator of drug activity B, putative	0.0062	0.222	0.1758
Echinococcus multilocularis	roundabout 2	0.0018	0.0376	0.1598
Trichomonas vaginalis	conserved hypothetical protein	0.0247	1	1
Echinococcus multilocularis	Immunoglobulin	0.0011	0.0101	0.041
Trichomonas vaginalis	NAD(P)H dehydrogenase, putative	0.0247	1	1
Trichomonas vaginalis	modulator of drug activity B, putative	0.0062	0.222	0.1758
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0101	0.0129
Trichomonas vaginalis	conserved hypothetical protein	0.0247	1	1
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0046	0.1583	0.6819
Schistosoma mansoni	defective proboscis extension response (dpr)-related	0.0011	0.0101	0.0436
Echinococcus granulosus	tyrosine protein kinase Src64B	0.0046	0.1583	0.6819
Echinococcus multilocularis	tyrosine protein kinase Src42A	0.004	0.13	0.5595
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0255	0.0339
Trichomonas vaginalis	modulator of drug activity B, putative	0.0062	0.222	0.1758
Loa Loa (eye worm)	TK/KIN16 protein kinase	0.0184	0.7356	1
Trichomonas vaginalis	conserved hypothetical protein	0.0062	0.222	0.1758
Trichomonas vaginalis	conserved hypothetical protein	0.0062	0.222	0.1758
Schistosoma mansoni	tyrosine kinase	0.0046	0.1583	0.6827
Brugia malayi	alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase	0.0016	0.0313	0.0418
Brugia malayi	Fibronectin type III domain containing protein	0.0011	0.0101	0.0129
Echinococcus granulosus	dihydrolipoamide dehydrogenase	0.0022	0.0561	0.2399
Brugia malayi	Tyrosine-protein kinase abl-1	0.0011	0.0103	0.0131
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0042	0.1396	0.6013
Trichomonas vaginalis	conserved hypothetical protein	0.0062	0.222	0.1758
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0376	0.0503
Wolbachia endosymbiont of Brugia malayi	dihydrolipoamide dehydrogenase E3 component	0.0022	0.0561	0.5
Plasmodium falciparum	thioredoxin reductase	0.0064	0.2318	1
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0046	0.1583	0.6819
Schistosoma mansoni	vesicular amine transporter	0.0011	0.0101	0.0436
Trichomonas vaginalis	FMN-dependent NADH-azoreductase, putative	0.0062	0.222	0.1758
Echinococcus granulosus	tyrosine kinase	0.0042	0.1396	0.6013
Mycobacterium ulcerans	dihydrolipoamide dehydrogenase, LpdB	0.0022	0.0561	0.5
Loa Loa (eye worm)	TK protein kinase	0.0042	0.1396	0.1891
Trichomonas vaginalis	conserved hypothetical protein	0.0247	1	1
Schistosoma mansoni	proto-oncogene tyrosine-protein kinase src	0.0011	0.0103	0.0443
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0101	0.0129
Wolbachia endosymbiont of Brugia malayi	dihydrolipoamide dehydrogenase E3 component	0.0022	0.0561	0.5
Brugia malayi	hypothetical protein	0.0011	0.0101	0.0129
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0022	0.0561	0.5
Echinococcus granulosus	tyrosine protein kinase Src42A	0.0046	0.1583	0.6819
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0376	0.0503
Mycobacterium ulcerans	flavoprotein disulfide reductase	0.0022	0.0561	0.5
Echinococcus multilocularis	proto oncogene tyrosine protein kinase LCK	0.0046	0.1583	0.6819
Trichomonas vaginalis	conserved hypothetical protein	0.0247	1	1
Schistosoma mansoni	tyrosine kinase	0.0011	0.0103	0.0443
Brugia malayi	glutathione reductase	0.0064	0.2318	0.3145
Echinococcus multilocularis	tyrosine protein kinase Srms	0.0042	0.1396	0.6013
Echinococcus granulosus	tyrosine protein kinase Fyn	0.0046	0.1583	0.6819
Schistosoma mansoni	cell adhesion molecule	0.0015	0.0255	0.11
Echinococcus granulosus	thioredoxin glutathione reductase	0.0064	0.2318	1
Brugia malayi	protein-tyrosine kinase	0.0042	0.1396	0.1891
Echinococcus granulosus	tyrosine protein kinase Lyn	0.0046	0.1583	0.6819
Entamoeba histolytica	modulator of drug activity B homolog, putative	0.0062	0.222	1
Echinococcus granulosus	neuroglian	0.0014	0.0222	0.0932
Echinococcus multilocularis	tyrosine protein kinase Btk29A	0.0011	0.0103	0.0418
Trichomonas vaginalis	conserved hypothetical protein	0.0185	0.7409	0.7255
Echinococcus multilocularis	basement membrane specific heparan sulfate	0.0011	0.0101	0.041
Trichomonas vaginalis	modulator of drug activity B, putative	0.0062	0.222	0.1758
Trichomonas vaginalis	NAD(P)H dehydrogenase, putative	0.0062	0.222	0.1758
Trichomonas vaginalis	conserved hypothetical protein	0.0062	0.222	0.1758
Schistosoma mansoni	tyrosine kinase	0.0046	0.1583	0.6827
Trichomonas vaginalis	conserved hypothetical protein	0.0247	1	1
Trypanosoma cruzi	trypanothione reductase, putative	0.0064	0.2318	1
Trichomonas vaginalis	modulator of drug activity B, putative	0.0062	0.222	0.1758

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.005 uM	Inhibitory activity against c-Src kinase	ChEMBL.	16203139
IC50 (binding)	= 0.005 uM	Inhibitory activity against c-Src kinase	ChEMBL.	16203139
IC50 (functional)	= 0.07 uM	Inhibition of Src-transfected 3T3 cell proliferation	ChEMBL.	16203139
IC50 (functional)	= 0.07 uM	Inhibition of Src-transfected 3T3 cell proliferation	ChEMBL.	16203139
IC50 (functional)	= 0.16 uM	Inhibition of A549 cell migration	ChEMBL.	16203139
IC50 (functional)	= 0.16 uM	Inhibition of A549 cell migration	ChEMBL.	16203139
IC50 (binding)	= 5.5 uM	Inhibitory activity against KDR	ChEMBL.	16203139
IC50 (binding)	= 5.5 uM	Inhibitory activity against KDR	ChEMBL.	16203139

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	ChEMBL23	16203139

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: CHEMBL424664

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 346346