TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 378.451 | Formula: C20H24N7O+
H donors: 2 H acceptors: 0 LogP: 2.58 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: N=C(NN1CCOCC1)N/N=C/c1ccc(cc1)c1cn2c([n+]1C)cccc2
InChi: 1S/C20H24N7O/c1-25-18(15-26-9-3-2-4-19(25)26)17-7-5-16(6-8-17)14-22-23-20(21)24-27-10-12-28-13-11-27/h2-9,14-15H,10-13H2,1H3,(H3,21,23,24)/q+1/b22-14+
InChiKey: CPPMWRMJUUIVEZ-HYARGMPZSA-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

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

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)	Csnk2b protein	0.0075	0.1023	0.1023
Loa Loa (eye worm)	CMGC/CDK/CDC2 protein kinase	0.0051	0.0568	0.0568
Toxoplasma gondii	ck2 beta subunit	0.0075	0.1023	0.0482
Echinococcus multilocularis	dual specificity	0.0062	0.0771	0.0771
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0022	0.0006	0.0006
Entamoeba histolytica	protein kinase, putative	0.0062	0.0771	0.0765
Plasmodium vivax	casein kinase II beta chain, putative	0.0075	0.1023	0.0482
Loa Loa (eye worm)	hypothetical protein	0.0095	0.1399	0.1399
Giardia lamblia	Kinase, CMGC DYRK	0.0062	0.0771	0.0765
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0109	0.1674	0.1674
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0075	0.1023	0.1023
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.0109	0.1674	0.1674
Trichomonas vaginalis	CMGC family protein kinase	0.0062	0.0771	0.0771
Loa Loa (eye worm)	CAMK/PIM protein kinase	0.0175	0.2918	0.2918
Echinococcus multilocularis	cyclin dependent kinase 1	0.0051	0.0568	0.0568
Trypanosoma cruzi	Casein kinase II subunit beta, putative	0.0075	0.1023	0.0482
Schistosoma mansoni	serine/threonine protein kinase	0.0185	0.3116	0.3116
Loa Loa (eye worm)	CAMK/PIM protein kinase	0.0175	0.2918	0.2918
Trichomonas vaginalis	CMGC family protein kinase	0.0062	0.0771	0.0771
Echinococcus granulosus	casein kinase ii subunit beta	0.0075	0.1023	0.1023
Trypanosoma cruzi	glycogen synthase kinase 3, putative	0.0057	0.0667	0.0105
Echinococcus multilocularis	protein kinase shaggy	0.0057	0.0667	0.0667
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0075	0.1023	0.1023
Brugia malayi	Protein kinase domain containing protein	0.0175	0.2918	0.2918
Echinococcus granulosus	casein kinase ii subunit alpha	0.0546	1	1
Loa Loa (eye worm)	CMGC/DYRK/DYRK2 protein kinase	0.0062	0.0771	0.0771
Echinococcus multilocularis	proto oncogene serine:threonine protein kinase	0.0175	0.2918	0.2918
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0075	0.1023	0.1023
Plasmodium vivax	glycogen synthase kinase 3, putative	0.0057	0.0667	0.0105
Schistosoma mansoni	casein kinase II beta subunit	0.0075	0.1023	0.1023
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0075	0.1023	0.1023
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0109	0.1674	0.1674
Giardia lamblia	Kinase, CMGC GSK	0.0057	0.0667	0.0661
Echinococcus multilocularis	cyclin dependent kinase	0.0051	0.0568	0.0568
Echinococcus granulosus	cyclin dependent kinase 5	0.0051	0.0568	0.0568
Loa Loa (eye worm)	CMGC/GSK protein kinase	0.0057	0.0667	0.0667
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0075	0.1023	0.1023
Plasmodium falciparum	casein kinase 2, alpha subunit	0.0546	1	1
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0022	0.0006	0.0006
Brugia malayi	Dual-specificity tyrosine-phosphorylation regulated kinase 2	0.0062	0.0771	0.0771
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0022	0.0006	0.0006
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0022	0.0006	0.0006
Trichomonas vaginalis	CMGC family protein kinase	0.0546	1	1
Trichomonas vaginalis	CMGC family protein kinase	0.0051	0.0568	0.0568
Loa Loa (eye worm)	CMGC/CDK/CDK5 protein kinase	0.0051	0.0568	0.0568
Plasmodium vivax	casein kinase 2, alpha subunit, putative	0.0546	1	1
Schistosoma mansoni	serine/threonine protein kinase	0.0051	0.0568	0.0568
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0075	0.1023	0.1023
Loa Loa (eye worm)	CMGC/DYRK/HIPK protein kinase	0.0185	0.3116	0.3116
Echinococcus granulosus	dual specificity	0.0062	0.0771	0.0771
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.0109	0.1674	0.1674
Brugia malayi	Protein kinase domain containing protein	0.0051	0.0568	0.0568
Leishmania major	glycogen synthase kinase, putative;with=GeneDB:LinJ18_V3.0270	0.0057	0.0667	0.0105
Trypanosoma brucei	Casein kinase II	0.0546	1	1
Echinococcus granulosus	protein kinase shaggy	0.0057	0.0667	0.0667
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0032	0.0192	0.0192
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0022	0.0006	0.0006
Loa Loa (eye worm)	CMGC/CK2 protein kinase	0.0546	1	1
Echinococcus granulosus	glycogen synthase kinase 3 beta	0.0057	0.0667	0.0667
Plasmodium falciparum	casein kinase II beta chain	0.0075	0.1023	0.0482
Schistosoma mansoni	serine/threonine protein kinase	0.0051	0.0568	0.0568
Leishmania major	protein kinase, putative,dual-specificity protein kinase, putative	0.0062	0.0771	0.0215
Entamoeba histolytica	casein kinase, putative	0.0546	1	1
Echinococcus multilocularis	homeodomain interacting protein kinase 3	0.0185	0.3116	0.3116
Trichomonas vaginalis	CMGC family protein kinase	0.0546	1	1
Echinococcus multilocularis	dual specificity	0.0062	0.0771	0.0771
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0075	0.1023	0.1023
Plasmodium falciparum	glycogen synthase kinase 3	0.0057	0.0667	0.0105
Trichomonas vaginalis	CMGC family protein kinase	0.0062	0.0771	0.0771
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0022	0.0006	0.0006
Schistosoma mansoni	serine/threonine protein kinase	0.0175	0.2918	0.2918
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0022	0.0006	0.0006
Schistosoma mansoni	voltage-gated potassium channel	0.012	0.1866	0.1866
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0022	0.0006	0.0006
Toxoplasma gondii	cell-cycle-associated protein kinase DYRK2, putative	0.0062	0.0771	0.0215
Onchocerca volvulus	Casein kinase II subunit beta homolog	0.0075	0.1023	0.1581
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0075	0.1023	0.1023
Loa Loa (eye worm)	CMGC/CDK/CDC2 protein kinase	0.0051	0.0568	0.0568
Entamoeba histolytica	cell division protein kinase 2, putative	0.0051	0.0568	0.0562
Trichomonas vaginalis	CMGC family protein kinase	0.0062	0.0771	0.0771
Loa Loa (eye worm)	hypothetical protein	0.0045	0.045	0.045
Schistosoma mansoni	voltage-gated potassium channel	0.0032	0.0192	0.0192
Trichomonas vaginalis	CMGC family protein kinase	0.0057	0.0667	0.0667
Leishmania major	casein kinase II, putative	0.0546	1	1
Trypanosoma cruzi	Casein kinase II subunit beta, putative	0.0075	0.1023	0.0482
Schistosoma mansoni	glycogen synthase kinase 3-related (gsk3) (cmgc group III)	0.0057	0.0667	0.0667
Trichomonas vaginalis	CMGC family protein kinase	0.0051	0.0568	0.0568
Entamoeba histolytica	protein kinase, putative	0.0057	0.0667	0.0661
Trichomonas vaginalis	CMGC family protein kinase	0.0051	0.0568	0.0568
Giardia lamblia	Kinase, CMGC CK2	0.0546	1	1
Toxoplasma gondii	casein kinase ii regulatory subunit protein	0.0075	0.1023	0.0482
Giardia lamblia	Kinase, CMGC GSK	0.0057	0.0667	0.0661
Plasmodium vivax	casein kinase II beta chain, putative	0.0075	0.1023	0.0482
Echinococcus multilocularis	cyclin dependent kinase 5	0.0051	0.0568	0.0568
Trichomonas vaginalis	protein kinase ck2-beta, putative	0.0022	0.0006	0.0006
Brugia malayi	Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog	0.0032	0.0192	0.0192
Entamoeba histolytica	casein kinase II regulatory subunit family protein	0.0075	0.1023	0.1017
Loa Loa (eye worm)	CMGC/GSK protein kinase	0.0057	0.0667	0.0667
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0022	0.0006	0.0006
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0022	0.0006	0.0006
Trichomonas vaginalis	CMGC family protein kinase	0.0546	1	1
Trichomonas vaginalis	CMGC family protein kinase	0.0062	0.0771	0.0771
Schistosoma mansoni	serine/threonine protein kinase	0.0062	0.0771	0.0771
Echinococcus multilocularis	casein kinase ii subunit alpha	0.0546	1	1
Brugia malayi	Serine/threonine-protein kinase Pim-3	0.0175	0.2918	0.2918
Schistosoma mansoni	voltage-gated potassium channel	0.012	0.1866	0.1866
Giardia lamblia	Kinase, CMGC CDK	0.0051	0.0568	0.0562
Trichomonas vaginalis	CMGC family protein kinase	0.0546	1	1
Schistosoma mansoni	voltage-gated potassium channel	0.0032	0.0192	0.0192
Trichomonas vaginalis	CMGC family protein kinase	0.0062	0.0771	0.0771
Echinococcus granulosus	dual specificity	0.0062	0.0771	0.0771
Entamoeba histolytica	casein kinase II regulatory subunit family protein	0.0075	0.1023	0.1017
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0022	0.0006	0.0006
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0075	0.1023	0.1023
Echinococcus multilocularis	dual specificity	0.0062	0.0771	0.0771
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0075	0.1023	0.1023
Entamoeba histolytica	protein kinase domain containing protein	0.0057	0.0667	0.0661
Trypanosoma cruzi	dual specificity tyrosine-phosphorylation-regulated kinase 2, putative	0.0062	0.0771	0.0215
Trichomonas vaginalis	CMGC family protein kinase	0.0546	1	1
Echinococcus multilocularis	cyclin dependent kinase 1	0.0051	0.0568	0.0568
Brugia malayi	Homeodomain interacting protein kinase protein 1	0.0185	0.3116	0.3116
Echinococcus multilocularis	glycogen synthase kinase 3 beta	0.0057	0.0667	0.0667
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0102	0.1537	0.1537
Brugia malayi	casein kinase II, putaitve	0.0022	0.0006	0.0006
Brugia malayi	intracellular kinase	0.0057	0.0667	0.0667
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0075	0.1023	0.1023
Entamoeba histolytica	protein kinase domain containing protein	0.0185	0.3116	0.3112
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0192	0.0192
Trypanosoma cruzi	casein kinase II, putative	0.0546	1	1
Brugia malayi	cell division control protein 2 homolog	0.0051	0.0568	0.0568
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0075	0.1023	0.1023
Echinococcus multilocularis	voltage gated potassium channel	0.0032	0.0192	0.0192
Toxoplasma gondii	CMGC kinase, CK2 family	0.0546	1	1
Entamoeba histolytica	protein kinase domain containing protein	0.0062	0.0771	0.0765
Schistosoma mansoni	protein kinase	0.0546	1	1
Echinococcus granulosus	cyclin dependent kinase	0.0051	0.0568	0.0568
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0022	0.0006	0.0006
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0022	0.0006	0.0006
Onchocerca volvulus	Casein kinase II subunit beta homolog	0.0075	0.1023	0.1581
Plasmodium vivax	unspecified product	0.0546	1	1
Loa Loa (eye worm)	casein kinase II	0.0022	0.0006	0.0006
Trypanosoma brucei	dual specificity tyrosine-phosphorylation-regulated kinase 2, putative	0.0062	0.0771	0.0215
Trichomonas vaginalis	CMGC family protein kinase	0.0057	0.0667	0.0667
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0075	0.1023	0.1023
Echinococcus granulosus	cyclin dependent kinase 1	0.0051	0.0568	0.0568
Echinococcus granulosus	homeodomain interacting protein kinase 3	0.0185	0.3116	0.3116
Echinococcus granulosus	proto oncogene serine:threonine protein kinase	0.0175	0.2918	0.2918
Entamoeba histolytica	cell division protein kinase 2, putative	0.0051	0.0568	0.0562
Echinococcus multilocularis	casein kinase ii subunit beta	0.0075	0.1023	0.1023
Echinococcus granulosus	voltage gated potassium channel	0.0032	0.0192	0.0192
Trichomonas vaginalis	CMGC family protein kinase	0.0546	1	1
Onchocerca volvulus	Serine\/threonine protein kinase homolog	0.0175	0.2918	1
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0032	0.0192	0.0192
Echinococcus granulosus	dual specificity	0.0062	0.0771	0.0771
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0075	0.1023	0.1023
Trichomonas vaginalis	CMGC family protein kinase	0.0546	1	1
Leishmania major	protein kinase ck2 regulatory subunit, putative	0.0075	0.1023	0.0482
Entamoeba histolytica	protein kinase domain containing protein	0.0057	0.0667	0.0661
Toxoplasma gondii	cell-cycle-associated protein kinase GSK, putative	0.0057	0.0667	0.0105
Trypanosoma brucei	Casein kinase II subunit beta, putative	0.0075	0.1023	0.0482
Giardia lamblia	Kinase, CMGC CDK	0.0051	0.0568	0.0562
Trypanosoma brucei	protein kinase, putative	0.0057	0.0667	0.0105
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0075	0.1023	0.1023
Entamoeba histolytica	protein kinase domain containing protein	0.0546	1	1
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0102	0.1537	0.1537
Echinococcus granulosus	5'partial\|cyclin dependent kinase 1	0.0051	0.0568	0.0568
Plasmodium falciparum	casein kinase II beta chain	0.0075	0.1023	0.0482
Brugia malayi	Csnk2b protein	0.0075	0.1023	0.1023
Giardia lamblia	Casein kinase II beta chain	0.0075	0.1023	0.1017
Entamoeba histolytica	casein kinase II regulatory subunit family protein	0.0075	0.1023	0.1017
Trichomonas vaginalis	protein kinase ck2-beta, putative	0.0022	0.0006	0.0006

Activities

No activities found for this compound.

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: CHEMBL1626851

Bibliographic References

No literature references available for this target.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 1470028