TDR Targets

Basic information

Technical information

TDR Targets ID: 433089
Name: 3-[7-(3-hydroxyphenyl)pteridin-6-yl]phenol
MW: 316.313 | Formula: C18H12N4O2
H donors: 2 H acceptors: 6 LogP: 2.44 Rotable bonds: 2
Rule of 5 violations (Lipinski): 1
SMILES: Oc1cccc(c1)c1nc2ncncc2nc1c1cccc(c1)O
InChi: 1S/C18H12N4O2/c23-13-5-1-3-11(7-13)16-17(12-4-2-6-14(24)8-12)22-18-15(21-16)9-19-10-20-18/h1-10,23-24H
InChiKey: CCAGYSMBBCSYDP-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

3-[7-(3-hydroxyphenyl)-6-pteridinyl]phenol

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	phosphatidylinositol-4,5-bisphosphate 3-kinase, catalytic subunit gamma	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Leishmania donovani	phosphatidylinositol 3-kinase 2, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Entamoeba histolytica	phosphatidylinositol 3-kinase 1, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	Get druggable targets OG5_127444	All targets in OG5_127444
Schistosoma japonicum	ko:K00922 phosphatidylinositol-4,5-bisphosphate 3-kinase [EC2.7.1.153], putative	Get druggable targets OG5_127444	All targets in OG5_127444
Echinococcus granulosus	phosphatidylinositol 45 bisphosphate 3 kinase	Get druggable targets OG5_127444	All targets in OG5_127444
Leishmania infantum	phosphatidylinositol 3-kinase 2, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_127444	All targets in OG5_127444
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	Get druggable targets OG5_127444	All targets in OG5_127444
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Loa Loa (eye worm)	phosphatidylinositol 3	Get druggable targets OG5_127444	All targets in OG5_127444
Entamoeba histolytica	hypothetical protein	Get druggable targets OG5_127444	All targets in OG5_127444
Echinococcus multilocularis	phosphatidylinositol 4,5 bisphosphate 3 kinase	Get druggable targets OG5_127444	All targets in OG5_127444
Giardia lamblia	Phosphoinositide-3-kinase, catalytic, alpha polypeptide	Get druggable targets OG5_127444	All targets in OG5_127444
Trichomonas vaginalis	phosphatidylinositol kinase, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Leishmania mexicana	phosphatidylinositol 3-kinase, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit gamma, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	Get druggable targets OG5_127444	All targets in OG5_127444

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	phosphatidylinositol kinase, putative	0.009	0.0024	0.0512
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Toxoplasma gondii	non-specific serine/threonine protein kinase	0.0145	0.0197	0.1478
Entamoeba histolytica	hypothetical protein	0.013	0.0151	0.29
Echinococcus granulosus	FKBP12 rapamycin complex associated protein	0.0228	0.0462	0.0418
Brugia malayi	FAT domain containing protein	0.0097	0.0046	0.051
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.014	0.0183	0.3967
Loa Loa (eye worm)	phosphatidylinositol 3	0.0156	0.0233	0.5036
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Trypanosoma cruzi	hypothetical protein, conserved	0.1122	0.332	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Toxoplasma gondii	target of rapamycin (TOR), putative	0.0228	0.0462	1
Entamoeba histolytica	phosphatidylinositol3-kinaseTor2, putative	0.0228	0.0462	1
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0185	0.0325	0.7039
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Schistosoma mansoni	ataxia telangiectasia mutated (atm)	0.013	0.0151	0.29
Loa Loa (eye worm)	phosphatidylinositol 3	0.0228	0.0462	1
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.0228	0.0462	0.1392
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0185	0.0325	0.6879
Trichomonas vaginalis	PIKK family atypical protein kinase	0.013	0.0151	0.3263
Trichomonas vaginalis	PIKK family atypical protein kinase	0.013	0.0151	0.3263
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Loa Loa (eye worm)	hypothetical protein	0.0145	0.0197	0.4258
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Trypanosoma cruzi	target of rapamycin kinase 3	0.0228	0.0462	0.1392
Trichomonas vaginalis	PIKK family atypical protein kinase	0.013	0.0151	0.3263
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0145	0.0197	0.4258
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.014	0.0183	0.3967
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0228	0.0462	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.013	0.0151	0.3263
Echinococcus multilocularis	serine:threonine protein kinase SMG1	0.013	0.0151	0.0105
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Echinococcus granulosus	phosphatidylinositol 4 phosphate 3 kinase C2	0.0135	0.0166	0.012
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0185	0.0325	0.6879
Entamoeba histolytica	FKBP-rapamycin associated protein (FRAP), putative	0.0228	0.0462	1
Echinococcus granulosus	serine:threonine protein kinase SMG1	0.013	0.0151	0.0105
Trypanosoma brucei	FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative	0.0145	0.0197	0.3949
Trichomonas vaginalis	conserved hypothetical protein	0.0097	0.0046	0.0995
Giardia lamblia	GTOR	0.0228	0.0462	1
Echinococcus granulosus	phosphatidylinositol 45 bisphosphate 3 kinase	0.0185	0.0325	0.0281
Schistosoma mansoni	fkbp-rapamycin associated protein	0.013	0.0151	0.29
Entamoeba histolytica	hypothetical protein	0.0156	0.0233	0.4768
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.009	0.0024	0.0512
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Echinococcus multilocularis	FKBP12 rapamycin complex associated protein	0.0228	0.0462	0.0418
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.0228	0.0462	1
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.013	0.0151	0.0454
Trypanosoma brucei	phosphatidylinositol kinase related protein, putative	0.013	0.0151	0.29
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0185	0.0325	0.098
Loa Loa (eye worm)	hypothetical protein	0.0135	0.0166	0.3583
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor2	0.0228	0.0462	0.1392
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.0228	0.0462	1
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0185	0.0325	0.6879
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.009	0.0024	0.0512
Schistosoma mansoni	phosphatidylinositol 3-and 4-kinase	0.0228	0.0462	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Echinococcus multilocularis	phosphatidylinositol 3 and 4 kinase	0.0228	0.0462	0.0418
Echinococcus granulosus	serine protein kinase ATM	0.013	0.0151	0.0105
Entamoeba histolytica	protein kinase rad3, putative	0.013	0.0151	0.29
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	0.0228	0.0462	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Entamoeba histolytica	Phosphatidylinositol 3- and 4-kinase family	0.013	0.0151	0.29
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Schistosoma mansoni	hypothetical protein	0.0097	0.0046	0.051
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.013	0.0151	0.0454
Loa Loa (eye worm)	hypothetical protein	0.0097	0.0046	0.0995
Echinococcus multilocularis	phosphatidylinositol 4 phosphate 3 kinase C2	0.0135	0.0166	0.012
Trichomonas vaginalis	PIKK family atypical protein kinase	0.013	0.0151	0.3263
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Trypanosoma cruzi	phosphatidylinositol 3-kinase vps34-like	0.009	0.0024	0.0071
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.013	0.0151	0.3263
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0106	0.0073	0.1126
Echinococcus granulosus	phosphatidylinositol 3 and 4 kinase	0.0228	0.0462	0.0418
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.013	0.0151	0.29
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Loa Loa (eye worm)	hypothetical protein	0.013	0.0151	0.3263
Echinococcus multilocularis	serine protein kinase ATM	0.013	0.0151	0.0105
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit gamma, putative	0.0185	0.0325	0.7039
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.0228	0.0462	0.1392
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.013	0.0151	0.29
Loa Loa (eye worm)	phosphatidylinositol 3	0.0228	0.0462	1
Entamoeba histolytica	phosphatidylinositol 3-kinase 1, putative	0.0138	0.0175	0.344
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Echinococcus multilocularis	phosphatidylinositol 4,5 bisphosphate 3 kinase	0.0185	0.0325	0.0281
Trypanosoma brucei	phosphatidylinositol 3-related kinase, putative	0.0228	0.0462	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.013	0.0151	0.3263
Trypanosoma brucei	target of rapamycin kinase 3, putative	0.0228	0.0462	1
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0156	0.0233	0.4768
Echinococcus multilocularis	DNA dependent protein kinase catalytic subunit	0.3213	1	1
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0185	0.0325	0.098
Trichomonas vaginalis	conserved hypothetical protein	0.0145	0.0197	0.4258
Trichomonas vaginalis	PIKK family atypical protein kinase	0.013	0.0151	0.3263
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor1	0.0228	0.0462	0.1392
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0135	0.0166	0.3237
Leishmania major	hypothetical protein, conserved	0.117	0.3471	1
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.0185	0.0325	0.7039
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0228	0.0462	1
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0228	0.0462	1
Schistosoma mansoni	ataxia telangiectasia mutated (atm)-related	0.0228	0.0462	1

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 9 uM	Inhibition of recombinant PI3Kgamma	ChEMBL.	17685602
IC50 (binding)	= 9 uM	Inhibition of recombinant PI3Kgamma	ChEMBL.	17685602

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

PubChem: 17755300

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 433089