TDR Targets

Basic information

Technical information

TDR Targets ID: 615771
Name: 3-methyl-7-propan-2-yl-8-((2E)-2-(pyridin-3-y lmethylidene)hydrazinyl)purine-2,6-dione
MW: 327.341 | Formula: C15H17N7O2
H donors: 2 H acceptors: 4 LogP: 0.97 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: O=c1[nH]c(=O)n(c2c1n(C(C)C)c(n2)N/N=C/c1cccnc1)C
InChi: 1S/C15H17N7O2/c1-9(2)22-11-12(21(3)15(24)19-13(11)23)18-14(22)20-17-8-10-5-4-6-16-7-10/h4-9H,1-3H3,(H,18,20)(H,19,23,24)/b17-8+
InChiKey: WQDJRKHPVQXTMC-CAOOACKPSA-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

3-methyl-7-propan-2-yl-8-(2-(pyridin-3-ylmethylidene)hydrazinyl)purine-2,6-dione
7-isopropyl-3-methyl-8-(N'-(3-pyridylmethylene)hydrazino)purine-2,6-dione
7-isopropyl-3-methyl-8-((N'E)-N'-(3-pyridylmethylene)hydrazino)purine-2,6-dione
7-isopropyl-3-methyl-8-((N'E)-N'-(3-pyridylmethylene)hydrazino)xanthine
7-isopropyl-3-methyl-8-(N'-(3-pyridylmethylene)hydrazino)xanthine
STOCK4S-69171

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
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.03	0.3655	1
Brugia malayi	nuclear hormone receptor	0.03	0.3655	0.3655
Loa Loa (eye worm)	jmjC domain-containing protein	0.0058	0.0331	0.0331
Onchocerca volvulus		0.013	0.132	0.0578
Echinococcus multilocularis	nuclear receptor nhr 48	0.013	0.132	0.3611
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.03	0.3655	0.3655
Brugia malayi	nuclear hormone receptor family member odr-7	0.013	0.132	0.132
Loa Loa (eye worm)	hypothetical protein	0.017	0.1866	0.1866
Schistosoma mansoni	nuclear receptor nhr-48	0.013	0.132	0.3611
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.03	0.3655	1
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.013	0.132	0.0578
Loa Loa (eye worm)	nuclear hormone receptor	0.013	0.132	0.132
Loa Loa (eye worm)	nuclear receptor nhr-7B	0.013	0.132	0.132
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.03	0.3655	1
Trichomonas vaginalis	CAMK family protein kinase	0.0091	0.0787	1
Loa Loa (eye worm)	hypothetical protein	0.013	0.132	0.132
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.03	0.3655	0.5044
Trichomonas vaginalis	CAMK family protein kinase	0.0045	0.0153	0.0798
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.013	0.132	0.3611
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.03	0.3655	0.3655
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.03	0.3655	0.3655
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.017	0.1866	0.2575
Echinococcus multilocularis	FTZ F1 alpha	0.03	0.3655	1
Echinococcus multilocularis	ecdysone induced protein 78C	0.03	0.3655	1
Loa Loa (eye worm)	hypothetical protein	0.013	0.132	0.132
Schistosoma mansoni	kinase	0.0046	0.0169	0.0463
Plasmodium falciparum	histone acetyltransferase GCN5	0.0038	0.005	0.5
Loa Loa (eye worm)	hypothetical protein	0.0762	1	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.03	0.3655	0.3655
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.013	0.132	0.3611
Schistosoma mansoni	nuclear hormone receptor	0.013	0.132	0.3611
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.03	0.3655	0.5044
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.013	0.132	0.3611
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.013	0.132	0.132
Echinococcus granulosus	serine:threonine protein kinase PLK1	0.0091	0.0787	0.1086
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.03	0.3655	0.3113
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.03	0.3655	0.3655
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.03	0.3655	0.3655
Brugia malayi	orphan nuclear receptor NR2E1	0.013	0.132	0.132
Brugia malayi	nuclear receptor NHR-67	0.013	0.132	0.132
Trichomonas vaginalis	CAMK family protein kinase	0.0091	0.0787	1
Brugia malayi	Nuclear hormone receptor-like 1	0.03	0.3655	0.3655
Brugia malayi	Nuclear hormone receptor-like 1	0.017	0.1866	0.1866
Loa Loa (eye worm)	hypothetical protein	0.013	0.132	0.132
Onchocerca volvulus		0.03	0.3655	0.3113
Trichomonas vaginalis	CAMK family protein kinase	0.0091	0.0787	1
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.013	0.132	0.1822
Loa Loa (eye worm)	hypothetical protein	0.013	0.132	0.132
Loa Loa (eye worm)	hypothetical protein	0.013	0.132	0.132
Loa Loa (eye worm)	hypothetical protein	0.03	0.3655	0.3655
Brugia malayi	steroid hormone receptor	0.0731	0.9581	0.9581
Trypanosoma cruzi	polo-like protein kinase, putative	0.0091	0.0787	0.5
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.03	0.3655	0.5044
Brugia malayi	nuclear receptor NHR-88	0.013	0.132	0.132
Schistosoma mansoni	nuclear hormone receptor	0.03	0.3655	1
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.03	0.3655	0.3655
Schistosoma mansoni	nuclear receptor	0.013	0.132	0.3611
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.03	0.3655	0.3655
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.03	0.3655	0.3655
Plasmodium vivax	histone acetyltransferase GCN5, putative	0.0041	0.0098	0.5
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.03	0.3655	0.5044
Echinococcus multilocularis	gcn5proteinral control of amino acid synthesis	0.014	0.1458	0.399
Loa Loa (eye worm)	nuclear receptor NHR-67	0.013	0.132	0.132
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.017	0.1866	0.5105
Schistosoma mansoni	thyroid hormone receptor	0.03	0.3655	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.03	0.3655	0.3655
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.013	0.132	0.0578
Echinococcus multilocularis	serine:threonine protein kinase PLK1	0.0091	0.0787	0.2153
Brugia malayi	photoreceptor-specific nuclear receptor	0.03	0.3655	0.3655
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.03	0.3655	0.3655
Loa Loa (eye worm)	hypothetical protein	0.03	0.3655	0.3655
Loa Loa (eye worm)	steroid hormone receptor	0.0731	0.9581	0.9581
Schistosoma mansoni	RAR-like nuclear receptor	0.03	0.3655	1
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.03	0.3655	1
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.03	0.3655	1
Brugia malayi	nuclear receptor NHR-88	0.03	0.3655	0.3655
Brugia malayi	nuclear receptor RXR	0.017	0.1866	0.1866
Echinococcus granulosus	Nuclear hormone receptor HR96	0.013	0.132	0.1822
Loa Loa (eye worm)	hypothetical protein	0.017	0.1866	0.1866
Loa Loa (eye worm)	acetyltransferase	0.014	0.1458	0.1458
Loa Loa (eye worm)	hypothetical protein	0.017	0.1866	0.1866
Schistosoma mansoni	nuclear receptor	0.013	0.132	0.3611
Entamoeba histolytica	serine/threonine protein kinase, putative	0.0091	0.0787	1
Brugia malayi	hypothetical protein	0.017	0.1866	0.1866
Echinococcus granulosus	ecdysone induced protein 78C	0.03	0.3655	0.5044
Loa Loa (eye worm)	hypothetical protein	0.013	0.132	0.132
Echinococcus granulosus	Nuclear hormone receptor HR96	0.013	0.132	0.1822
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.03	0.3655	0.5044
Brugia malayi	jmjC domain containing protein	0.0092	0.0801	0.0801
Brugia malayi	tailless protein	0.013	0.132	0.132
Echinococcus granulosus	nuclear receptor nhr 48	0.013	0.132	0.1822
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.03	0.3655	0.3655
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.03	0.3655	0.3655
Trypanosoma brucei	polo-like protein kinase	0.0091	0.0787	0.5
Schistosoma mansoni	retinoic acid receptor RXR	0.03	0.3655	1
Echinococcus granulosus	Transcription factor JmjC domain containing protein	0.0092	0.0801	0.1105
Loa Loa (eye worm)	hypothetical protein	0.03	0.3655	0.3655
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.03	0.3655	0.5044
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.03	0.3655	0.3655
Onchocerca volvulus		0.013	0.132	0.0578
Echinococcus granulosus	thyroid hormone receptor alpha	0.0561	0.7246	1
Toxoplasma gondii	histone lysine acetyltransferase GCN5-A	0.0041	0.0098	0.5
Echinococcus multilocularis	jumonji domain containing protein	0.0039	0.007	0.0192
Loa Loa (eye worm)	hypothetical protein	0.0048	0.0195	0.0195
Brugia malayi	acetyltransferase, GNAT family protein	0.014	0.1458	0.1458
Loa Loa (eye worm)	hypothetical protein	0.013	0.132	0.132
Onchocerca volvulus	Protein ultraspiracle homolog	0.03	0.3655	0.3113
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.03	0.3655	0.3655
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.03	0.3655	0.3655
Brugia malayi	nuclear receptor RXR	0.013	0.132	0.132
Brugia malayi	Nuclear hormone receptor E75	0.013	0.132	0.132
Brugia malayi	hypothetical protein	0.013	0.132	0.132
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.013	0.132	0.3611
Brugia malayi	Nuclear hormone receptor-like 1	0.017	0.1866	0.1866
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.03	0.3655	0.3655
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0136	0.1404	0.1938
Trichomonas vaginalis	CAMK family protein kinase	0.0091	0.0787	1
Loa Loa (eye worm)	hypothetical protein	0.03	0.3655	0.3655
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.013	0.132	0.3611
Brugia malayi	ecdysone receptor	0.013	0.132	0.132
Schistosoma mansoni	thyroid hormone receptor	0.03	0.3655	1
Schistosoma mansoni	serine/threonine protein kinase	0.0091	0.0787	0.2153
Loa Loa (eye worm)	hypothetical protein	0.017	0.1866	0.1866
Echinococcus multilocularis	thyroid hormone receptor alpha	0.03	0.3655	1
Schistosoma mansoni	zinc finger protein	0.013	0.132	0.3611
Brugia malayi	conserved hypotetical protein	0.013	0.132	0.132
Onchocerca volvulus	Bile acid receptor homolog	0.0762	1	1
Brugia malayi	nuclear hormone receptor family member nhr-6	0.013	0.132	0.132
Brugia malayi	hypothetical protein	0.017	0.1866	0.1866
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.03	0.3655	0.3655
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.017	0.1866	0.5105
Schistosoma mansoni	gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2	0.014	0.1458	0.399
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.03	0.3655	1
Trichomonas vaginalis	CAMK family protein kinase	0.0091	0.0787	1
Trichomonas vaginalis	CAMK family protein kinase	0.0045	0.0153	0.0798
Trichomonas vaginalis	CAMK family protein kinase	0.0091	0.0787	1
Echinococcus granulosus	nuclear receptor subfamily 4 group A	0.013	0.132	0.1822
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0041	0.0098	0.0135
Loa Loa (eye worm)	DR-78	0.013	0.132	0.132
Brugia malayi	Nuclear hormone receptor E75	0.013	0.132	0.132
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.017	0.1866	0.5105
Loa Loa (eye worm)	hypothetical protein	0.013	0.132	0.132
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.03	0.3655	1
Brugia malayi	Steroid receptor seven-up type 2	0.03	0.3655	0.3655
Leishmania major	protein kinase, putative,polo-like protein kinase, putative	0.0091	0.0787	0.5
Toxoplasma gondii	histone lysine acetyltransferase GCN5-B	0.0041	0.0098	0.5
Brugia malayi	hypothetical protein	0.013	0.132	0.132
Brugia malayi	nuclear hormone receptor	0.013	0.132	0.132
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.03	0.3655	1
Brugia malayi	serine/threonine-protein kinase plk-2	0.0091	0.0787	0.0787
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.03	0.3655	0.3655
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.013	0.132	0.3611
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.017	0.1866	0.1866
Schistosoma mansoni	steroid hormone receptor ad4bp	0.03	0.3655	1
Loa Loa (eye worm)	hypothetical protein	0.013	0.132	0.132
Echinococcus multilocularis	Transcription factor, JmjC domain containing protein	0.0092	0.0801	0.219
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.03	0.3655	1
Loa Loa (eye worm)	hypothetical protein	0.013	0.132	0.132
Loa Loa (eye worm)	hypothetical protein	0.03	0.3655	0.3655
Loa Loa (eye worm)	hypothetical protein	0.03	0.3655	0.3655
Schistosoma mansoni	jumonji domain containing protein	0.0073	0.054	0.1476
Schistosoma mansoni	nuclear hormone receptor	0.013	0.132	0.3611
Trichomonas vaginalis	CAMK family protein kinase	0.0091	0.0787	1
Giardia lamblia	Kinase, PLK	0.0091	0.0787	1
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.03	0.3655	0.5044
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.03	0.3655	1
Echinococcus multilocularis	nuclear receptor subfamily 4 group A	0.013	0.132	0.3611
Echinococcus granulosus	FTZ F1 alpha	0.03	0.3655	0.5044
Loa Loa (eye worm)	PLK/PLK1 protein kinase	0.0091	0.0787	0.0787
Trypanosoma cruzi	polo-like protein kinase, putative	0.0091	0.0787	0.5
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.03	0.3655	1
Loa Loa (eye worm)	hypothetical protein	0.017	0.1866	0.1866
Echinococcus granulosus	jumonji domain containing protein	0.0039	0.007	0.0097
Loa Loa (eye worm)	hypothetical protein	0.03	0.3655	0.3655
Loa Loa (eye worm)	hypothetical protein	0.013	0.132	0.132
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.03	0.3655	1
Loa Loa (eye worm)	hypothetical protein	0.013	0.132	0.132
Loa Loa (eye worm)	hypothetical protein	0.013	0.132	0.132
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.03	0.3655	0.3655
Schistosoma mansoni	coup transcription factor	0.03	0.3655	1

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

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Bibliographic References

No literature references available for this target.

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Detailed information for compound 615771