TDR Targets

Basic information

Technical information

TDR Targets ID: 176086
Name: 3-(2,6-dichlorophenyl)-7-(2-diethylaminoethyl amino)-1-methyl-1,6-naphthyridin-2-one
MW: 419.347 | Formula: C21H24Cl2N4O
H donors: 1 H acceptors: 2 LogP: 4.43 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: CCN(CCNc1ncc2c(c1)n(C)c(=O)c(c2)c1c(Cl)cccc1Cl)CC
InChi: 1S/C21H24Cl2N4O/c1-4-27(5-2)10-9-24-19-12-18-14(13-25-19)11-15(21(28)26(18)3)20-16(22)7-6-8-17(20)23/h6-8,11-13H,4-5,9-10H2,1-3H3,(H,24,25)
InChiKey: ABAWTOZNWVBCHD-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

1,6-naphthyridin-2(1H)-one deriv. 7d

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
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
Schistosoma japonicum	Proto-oncogene tyrosine-protein kinase Yrk, putative	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
Echinococcus granulosus	proto oncogene tyrosine protein kinase LCK	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	tyrosine protein kinase Fyn	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 Src64B	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
Brugia malayi	protein-tyrosine 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 japonicum	Proto-oncogene tyrosine-protein kinase FYN, putative	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 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
Echinococcus granulosus	tyrosine protein kinase Src42A	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
Loa Loa (eye worm)	TK protein kinase	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
Schistosoma japonicum	ko:K05703 proto-oncogene tyrosine-protein kinase Fyn, putative	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 kinase	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
Echinococcus granulosus	tyrosine kinase\|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
Echinococcus multilocularis	tyrosine protein kinase lyn tyrosine protein kinase blk	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
Schistosoma japonicum	Proto-oncogene tyrosine-protein kinase FGR, 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
Schistosoma mansoni	tyrosine 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
Echinococcus multilocularis	tyrosine protein kinase Fyn	Get druggable targets OG5_127750	All targets in OG5_127750
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 multilocularis	tyrosine protein kinase Blk	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
Brugia malayi	SRC-1	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 Blk	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	Proto-oncogene tyrosine-protein kinase FYN, putative	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
Echinococcus multilocularis	tyrosine protein kinase Blk	0.0041	0.0495	0.0495
Brugia malayi	Alcohol dehydrogenase class III	0.0228	0.3497	1
Trichomonas vaginalis	alcohol dehydrogenase, putative	0.0028	0.0284	0.5
Echinococcus multilocularis	proto oncogene tyrosine protein kinase LCK	0.0045	0.0566	0.0566
Echinococcus granulosus	tyrosine protein kinase Lyn	0.0045	0.0566	0.0566
Mycobacterium ulcerans	NADP-dependent alcohol dehydrogenase AdhC	0.0028	0.0284	0.0812
Schistosoma mansoni	tyrosine kinase	0.0045	0.0566	0.1619
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0284	0.0812
Trypanosoma cruzi	NADP-dependent alcohol hydrogenase, putative	0.0028	0.0284	1
Leishmania major	oxidoreductase, putative	0.0028	0.0284	1
Trypanosoma cruzi	nuclear receptor binding factor, putative	0.0028	0.0284	1
Mycobacterium ulcerans	oxidoreductase	0.0028	0.0284	0.0812
Onchocerca volvulus	Putative alcohol dehydrogenase	0.0228	0.3497	1
Onchocerca volvulus		0.0028	0.0284	0.0481
Brugia malayi	SRC-1	0.0045	0.0566	0.1619
Brugia malayi	Tyrosine-protein kinase abl-1	0.001	0.0002	0.0006
Mycobacterium tuberculosis	Possible dehydrogenase	0.0028	0.0284	0.0812
Loa Loa (eye worm)	acyl carrier protein	0.0018	0.0121	0.0347
Mycobacterium ulcerans	zinc-dependent alcohol dehydrogenase AdhE2	0.0228	0.3497	1
Trypanosoma cruzi	NADP-dependent alcohol hydrogenase, putative	0.0028	0.0284	1
Toxoplasma gondii	quinone oxidoreductase, putative	0.0028	0.0284	0.0812
Brugia malayi	oxidoreductase, zinc-binding dehydrogenase family protein	0.0018	0.0121	0.0347
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0634	1	1
Echinococcus granulosus	c src tyrosine kinase	0.001	0.0002	0.0002
Mycobacterium ulcerans	NADPH quinone oxidoreductase FadB4	0.0028	0.0284	0.0812
Trichomonas vaginalis	alcohol dehydrogenase, putative	0.0028	0.0284	0.5
Schistosoma mansoni	tyrosine kinase	0.0045	0.0566	0.1619
Echinococcus granulosus	tyrosine kinase	0.0041	0.0495	0.0495
Leishmania major	d-xylulose reductase, putative	0.0028	0.0284	1
Mycobacterium tuberculosis	Possible zinc-containing alcohol dehydrogenase NAD dependent AdhB	0.0201	0.3051	0.8724
Toxoplasma gondii	Zn-containing alcohol dehydrogenase	0.0228	0.3497	1
Echinococcus multilocularis	tyrosine protein kinase Btk29A	0.001	0.0002	0.0002
Brugia malayi	oxidoreductase, zinc-binding dehydrogenase family protein	0.0028	0.0284	0.0812
Mycobacterium ulcerans	oxidoreductase FadB5	0.0028	0.0284	0.0812
Mycobacterium ulcerans	multifunctional mycocerosic acid synthase membrane-associated Mas	0.0028	0.0284	0.0812
Mycobacterium tuberculosis	Polyketide synthase Pks12	0.0028	0.0284	0.0812
Mycobacterium tuberculosis	Probable zinc-type alcohol dehydrogenase AdhD (aldehyde reductase)	0.0228	0.3497	1
Brugia malayi	oxidoreductase, zinc-binding dehydrogenase family protein	0.0018	0.0121	0.0347
Echinococcus multilocularis	tyrosine protein kinase Src42A	0.004	0.0475	0.0475
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0121	0.0347
Mycobacterium ulcerans	zinc-dependent alcohol dehydrogenase	0.0228	0.3497	1
Leishmania major	zinc-binding dehydrogenase-like protein	0.0018	0.0121	0.4279
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0045	0.0566	0.0566
Wolbachia endosymbiont of Brugia malayi	NADPH:quinone reductase	0.0028	0.0284	0.5
Mycobacterium tuberculosis	Possible oxidoreductase FadB5	0.0028	0.0284	0.0812
Leishmania major	quinone oxidoreductase, putative	0.0028	0.0284	1
Echinococcus granulosus	tyrosine protein kinase Fyn	0.0045	0.0566	0.0566
Trichomonas vaginalis	alcohol dehydrogenase, putative	0.0028	0.0284	0.5
Mycobacterium tuberculosis	Probable quinone reductase Qor (NADPH:quinone reductase) (zeta-crystallin homolog protein)	0.0028	0.0284	0.0812
Mycobacterium ulcerans	oxidoreductase	0.0018	0.0121	0.0347
Trypanosoma brucei	oxidoreductase, putative	0.0028	0.0284	1
Echinococcus granulosus	tyrosine protein kinase Src42A	0.0045	0.0566	0.0566
Echinococcus multilocularis	mitochondrial trans 2 enoyl coenzyme A reductase	0.0028	0.0284	0.0284
Mycobacterium ulcerans	Zn-dependent alcohol dehydrogenase, AdhX	0.0028	0.0284	0.0812
Mycobacterium leprae	Probable S-nitrosomycothiol reductase MscR	0.0228	0.3497	1
Echinococcus granulosus	3'partial\|tyrosine protein kinase Fgr	0.0045	0.0566	0.0566
Mycobacterium tuberculosis	Probable polyketide synthase Pks5	0.0028	0.0284	0.0812
Mycobacterium tuberculosis	Probable alcohol dehydrogenase Adh	0.0028	0.0284	0.0812
Leishmania major	oxidoreductase-like protein	0.0028	0.0284	1
Trypanosoma cruzi	oxidoreductase, putative	0.0028	0.0284	1
Loa Loa (eye worm)	SRC-1	0.0045	0.0566	0.1619
Echinococcus granulosus	tyrosine protein kinase Btk29A	0.001	0.0002	0.0002
Loa Loa (eye worm)	TK protein kinase	0.0036	0.0422	0.1208
Mycobacterium tuberculosis	Possible quinone oxidoreductase (NADPH:quinone oxidoreductase) (zeta-crystallin)	0.0028	0.0284	0.0812
Echinococcus multilocularis	tyrosine protein kinase lyn tyrosine protein kinase blk	0.0045	0.0566	0.0566
Echinococcus granulosus	tyrosine protein kinase Src64B	0.0045	0.0566	0.0566
Leishmania major	nuclear receptor binding factor-like protein	0.0018	0.0121	0.4279
Echinococcus granulosus	tyrosine protein kinase Fyn	0.0045	0.0566	0.0566
Schistosoma mansoni	zinc binding dehydrogenase	0.0028	0.0284	0.0812
Mycobacterium tuberculosis	Probable multifunctional mycocerosic acid synthase membrane-associated Mas	0.0028	0.0284	0.0812
Mycobacterium ulcerans	quinone oxidoreductase	0.0028	0.0284	0.0812
Mycobacterium tuberculosis	Probable polyketide synthase Pks7	0.0028	0.0284	0.0812
Echinococcus multilocularis	tyrosine protein kinase Src42A	0.0045	0.0566	0.0566
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0284	0.0812
Trypanosoma brucei	oxidoreductase, putative	0.0028	0.0284	1
Echinococcus multilocularis	tyrosine protein kinase Fgr	0.0045	0.0566	0.0566
Mycobacterium ulcerans	NADP-dependent oxidoreductase	0.0018	0.0121	0.0347
Mycobacterium tuberculosis	Probable NADP-dependent alcohol dehydrogenase AdhC	0.0028	0.0284	0.0812
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0045	0.0566	0.0566
Schistosoma mansoni	proto-oncogene tyrosine-protein kinase src	0.001	0.0002	0.0006
Loa Loa (eye worm)	alcohol dehydrogenase class III	0.0228	0.3497	1
Trypanosoma cruzi	NADP-dependent alcohol hydrogenase, putative	0.0028	0.0284	1
Echinococcus multilocularis	tyrosine protein kinase Srms	0.0041	0.0495	0.0495
Mycobacterium ulcerans	NADP-dependent alcohol dehydrogenase Adh	0.0028	0.0284	0.0812
Leishmania major	zinc binding dehydrogenase-like protein	0.0028	0.0284	1
Mycobacterium ulcerans	zinc-type alcohol dehydrogenase AdhD	0.0228	0.3497	1
Loa Loa (eye worm)	TK protein kinase	0.0041	0.0495	0.1416
Trypanosoma cruzi	oxidoreductase, putative	0.0018	0.0121	0.4279
Echinococcus granulosus	tyrosine kinase\|tyrosine protein kinase Fyn	0.0041	0.0495	0.0495
Echinococcus granulosus	mitochondrial trans 2 enoyl coenzyme A reductase	0.0028	0.0284	0.0284
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0041	0.0495	0.0495
Mycobacterium ulcerans	phenolpthiocerol synthesis type-I polyketide synthase PpsC	0.0028	0.0284	0.0812
Trypanosoma cruzi	nuclear receptor binding factor, putative	0.0028	0.0284	1
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0284	0.0812
Echinococcus multilocularis	tyrosine protein kinase Abl	0.001	0.0002	0.0002
Echinococcus granulosus	tyrosine protein kinase Fyn	0.0045	0.0566	0.0566
Brugia malayi	oxidoreductase, zinc-binding dehydrogenase family protein	0.0028	0.0284	0.0812
Mycobacterium ulcerans	dehydrogenase	0.0028	0.0284	0.0812
Toxoplasma gondii	type I fatty acid synthase, putative	0.0028	0.0284	0.0812
Mycobacterium tuberculosis	Possible dehydrogenase	0.0028	0.0284	0.0812
Echinococcus granulosus	tyrosine protein kinase Blk	0.0041	0.0495	0.0495
Trypanosoma brucei	Trans-2-enoyl-ACP reductase 2, putative	0.0018	0.0121	0.4279
Mycobacterium tuberculosis	Probable polyketide synthase Pks8	0.0028	0.0284	0.0812
Echinococcus multilocularis	tyrosine protein kinase HCK	0.0036	0.0422	0.0422
Mycobacterium tuberculosis	S-nitrosomycothiol reductase MscR	0.0028	0.0284	0.0812
Mycobacterium ulcerans	quinone oxidoreductase	0.0028	0.0284	0.0812
Schistosoma mansoni	tyrosine kinase	0.001	0.0002	0.0006
Echinococcus multilocularis	tyrosine protein kinase Src64B	0.0045	0.0566	0.0566
Mycobacterium ulcerans	quinone reductase Qor	0.0028	0.0284	0.0812
Trypanosoma cruzi	NADP-dependent alcohol hydrogenase, putative	0.0028	0.0284	1
Mycobacterium tuberculosis	Probable zinc-type alcohol dehydrogenase (E subunit) AdhE1	0.0201	0.3051	0.8724
Echinococcus granulosus	tyrosine protein kinase HCK	0.0036	0.0422	0.0422
Leishmania major	NADP-dependent alcohol dehydrogenase, putative	0.0028	0.0284	1
Mycobacterium tuberculosis	Polyketide synthase Pks2	0.0028	0.0284	0.0812
Brugia malayi	protein-tyrosine kinase	0.0041	0.0495	0.1416
Echinococcus multilocularis	c src tyrosine kinase	0.001	0.0002	0.0002
Echinococcus granulosus	proto oncogene tyrosine protein kinase LCK	0.0045	0.0566	0.0566
Echinococcus multilocularis	tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase	0.0045	0.0566	0.0566
Mycobacterium tuberculosis	Probable polyketide synthase Pks1	0.0028	0.0284	0.0812
Mycobacterium tuberculosis	Probable NADPH quinone oxidoreductase FadB4 (NADPH:quinone reductase) (zeta-crystallin)	0.0028	0.0284	0.0812
Mycobacterium tuberculosis	Probable oxidoreductase	0.0028	0.0284	0.0812
Mycobacterium ulcerans	zinc-containing alcohol dehydrogenase NAD dependent AdhB	0.0228	0.3497	1
Schistosoma mansoni	alcohol dehydrogenase	0.0228	0.3497	1
Entamoeba histolytica	protein kinase, putative	0.0036	0.0422	1
Echinococcus granulosus	tyrosine protein kinase Src42A	0.004	0.0475	0.0475
Mycobacterium tuberculosis	Probable alcohol dehydrogenase AdhA	0.0028	0.0284	0.0812
Mycobacterium ulcerans	zinc-containing alcohol dehydrogenase NAD-dependent AdhB	0.0228	0.3497	1
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0045	0.0566	0.0566
Trypanosoma cruzi	oxidoreductase, putative	0.0028	0.0284	1
Schistosoma mansoni	tyrosine kinase	0.001	0.0002	0.0006
Mycobacterium ulcerans	polyketide synthase	0.0028	0.0284	0.0812
Mycobacterium ulcerans	short-chain dehydrogenase	0.0028	0.0284	0.0812

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 13 uM	Inhibitory activity against avian c-Src tyrosine kinase was determined.	ChEMBL.	10956222
IC50 (binding)	= 13 uM	Inhibitory activity against avian c-Src tyrosine kinase was determined.	ChEMBL.	10956222
IC50 (binding)	= 33 uM	Inhibitory activity against fibroblast growth factor receptor 1	ChEMBL.	10956222
IC50 (binding)	= 33 uM	Inhibitory activity against fibroblast growth factor receptor 1	ChEMBL.	10956222
IC50 (binding)	> 50 uM	Inhibitory activity against mouse PDGF beta receptor tyrosine kinase	ChEMBL.	10956222
IC50 (binding)	> 50 uM	Inhibitory activity against mouse PDGF beta receptor tyrosine kinase	ChEMBL.	10956222

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?

In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.

In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

ChEMBL: CHEMBL107418
PubChem: 5328703

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 176086