TDR Targets

Basic information

Technical information

TDR Targets ID: 1443700
Name: 2-methoxy-8-[(3-methoxyphenyl)methyl]pteridin -7-one
MW: 298.297 | Formula: C15H14N4O3
H donors: 0 H acceptors: 3 LogP: 1.27 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: COc1cccc(c1)Cn1c(=O)cnc2c1nc(OC)nc2
InChi: 1S/C15H14N4O3/c1-21-11-5-3-4-10(6-11)9-19-13(20)8-16-12-7-17-15(22-2)18-14(12)19/h3-8H,9H2,1-2H3
InChiKey: AJSLMLWKZOJVSV-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

2-methoxy-8-[(3-methoxyphenyl)methyl]-7-pteridinone
2-methoxy-8-(3-methoxybenzyl)pteridin-7-one
NCGC00010742
PCOP-250293

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	cytochrome P450, family 1, subfamily A, polypeptide 2	Starlite/ChEMBL	No references
Homo sapiens	thyroid stimulating hormone receptor	Starlite/ChEMBL	No references
Homo sapiens	cytochrome P450, family 3, subfamily A, polypeptide 4	Starlite/ChEMBL	No references
Homo sapiens	arachidonate 15-lipoxygenase	Starlite/ChEMBL	No references
Homo sapiens	cytochrome P450, family 2, subfamily C, polypeptide 19	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Candida albicans	similar to C.maltosa N-alkane inducible cytochrome P-450, ALK8 CYP52A11	Get druggable targets OG5_126554	All targets in OG5_126554
Leishmania donovani	cytochrome p450-like protein	Get druggable targets OG5_126554	All targets in OG5_126554
Candida albicans	similar to C.maltosa N-alkane inducible cytochrome P-450, ALK8 CYP52A11	Get druggable targets OG5_126554	All targets in OG5_126554
Leishmania infantum	cytochrome p450-like protein	Get druggable targets OG5_126554	All targets in OG5_126554
Loa Loa (eye worm)	CYP4Cod1	Get druggable targets OG5_126554	All targets in OG5_126554
Candida albicans	closely related to C.maltosa N-alkane-inducible cytochrome P-450, alkane hydroxylating monooxygenase CYP52A3-b aka P450Alk1A (BA	Get druggable targets OG5_126554	All targets in OG5_126554
Leishmania major	cytochrome p450-like protein	Get druggable targets OG5_126554	All targets in OG5_126554
Trypanosoma brucei gambiense	cytochrome P450, putative	Get druggable targets OG5_126554	All targets in OG5_126554
Leishmania braziliensis	cytochrome p450-like protein	Get druggable targets OG5_126554	All targets in OG5_126554
Trypanosoma brucei	cytochrome P450, putative	Get druggable targets OG5_126554	All targets in OG5_126554
Trypanosoma cruzi	cytochrome P450, putative	Get druggable targets OG5_126554	All targets in OG5_126554
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_126554	All targets in OG5_126554
Brugia malayi	Cytochrome P450 family protein	Get druggable targets OG5_126582	All targets in OG5_126582
Trypanosoma cruzi	cytochrome P450, putative	Get druggable targets OG5_126554	All targets in OG5_126554
Brugia malayi	Cytochrome P450 family protein	Get druggable targets OG5_126554	All targets in OG5_126554
Brugia malayi	follicle stimulating hormone receptor	Get druggable targets OG5_130089	All targets in OG5_130089
Candida albicans	cytochrome P450 556	Get druggable targets OG5_126554	All targets in OG5_126554
Loa Loa (eye worm)	follicle stimulating hormone receptor	Get druggable targets OG5_130089	All targets in OG5_130089
Loa Loa (eye worm)	cytochrome P450 family protein	Get druggable targets OG5_126582	All targets in OG5_126582
Candida albicans	cytochrome P450 56	Get druggable targets OG5_126554	All targets in OG5_126554
Loa Loa (eye worm)	cytochrome P450 family protein	Get druggable targets OG5_126554	All targets in OG5_126554
Loa Loa (eye worm)	cytochrome P450 family protein	Get druggable targets OG5_126554	All targets in OG5_126554
Brugia malayi	Cytochrome P450 family protein	Get druggable targets OG5_126554	All targets in OG5_126554
Trypanosoma congolense	cytochrome P450, putative	Get druggable targets OG5_126554	All targets in OG5_126554
Mycobacterium ulcerans	cytochrome P450 185A4 Cyp185A4	Get druggable targets OG5_126554	All targets in OG5_126554
Leishmania mexicana	cytochrome p450-like protein	Get druggable targets OG5_126554	All targets in OG5_126554

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Leishmania major	cytochrome p450-like protein	cytochrome P450, family 2, subfamily C, polypeptide 19	490 aa	411 aa	23.1 %
Brugia malayi	Cytochrome P450 family protein	cytochrome P450, family 1, subfamily A, polypeptide 2	516 aa	470 aa	26.2 %
Brugia malayi	cytochrome P450	cytochrome P450, family 3, subfamily A, polypeptide 4	502 aa	492 aa	24.2 %
Echinococcus granulosus	arachidonate 5 lipoxygenase	arachidonate 15-lipoxygenase	662 aa	590 aa	23.9 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Brugia malayi	latrophilin 2 splice variant baaae	0.0103	0.2852	0.2852
Echinococcus granulosus	acetylcholinesterase	0.0132	0.3875	0.6093
Onchocerca volvulus		0.0031	0.0293	1
Onchocerca volvulus		0.0026	0.013	0.4418
Echinococcus multilocularis	lipoxygenase domain containing protein	0.0024	0.0051	0.0079
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0031	0.0293	0.0559
Echinococcus granulosus	Polycystic kidney disease protein	0.0024	0.0051	0.0079
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0293	0.0293
Schistosoma mansoni	lamin	0.0026	0.013	0.0247
Trypanosoma brucei	cytochrome P450, putative	0.0023	0.0036	0.5
Brugia malayi	Cytochrome P450 family protein	0.0023	0.0036	0.0036
Schistosoma mansoni	RAR-like nuclear receptor	0.0031	0.0293	0.0559
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0293	0.0293
Schistosoma mansoni	hypothetical protein	0.0048	0.0897	0.1708
Mycobacterium ulcerans	cytochrome P450 185A4 Cyp185A4	0.0023	0.0036	1
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0031	0.0293	0.0461
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0293	0.0293
Echinococcus multilocularis	GPCR, family 2	0.0048	0.0897	0.141
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0031	0.0293	0.0293
Echinococcus granulosus	intermediate filament protein	0.0026	0.013	0.0204
Schistosoma mansoni	coup transcription factor	0.0031	0.0293	0.0559
Echinococcus granulosus	carboxylesterase 5A	0.0132	0.3875	0.6093
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0031	0.0293	0.0461
Brugia malayi	Doublecortin family protein	0.0024	0.0051	0.0051
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0031	0.0293	0.0293
Echinococcus multilocularis	musashi	0.0026	0.013	0.0204
Echinococcus granulosus	FTZ F1 alpha	0.0031	0.0293	0.0461
Echinococcus multilocularis	RUN	0.0024	0.0051	0.0079
Brugia malayi	intermediate filament protein	0.0026	0.013	0.013
Loa Loa (eye worm)	cytochrome P450 family protein	0.0023	0.0036	0.0036
Echinococcus granulosus	ecdysone induced protein 78C	0.0031	0.0293	0.0461
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0031	0.0293	0.0293
Loa Loa (eye worm)	hypothetical protein	0.0132	0.3875	0.3875
Brugia malayi	Cytochrome P450 family protein	0.0036	0.0475	0.0475
Echinococcus multilocularis	lipoxygenase domain containing protein	0.0024	0.0051	0.0079
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0031	0.0293	0.0559
Brugia malayi	Carboxylesterase family protein	0.0132	0.3875	0.3875
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0031	0.0293	0.0293
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0031	0.0293	0.0293
Echinococcus granulosus	lipoxygenase domain containing protein	0.0024	0.0051	0.0079
Schistosoma mansoni	hypothetical protein	0.0048	0.0897	0.1708
Loa Loa (eye worm)	carboxylesterase	0.0132	0.3875	0.3875
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0031	0.0293	0.0559
Brugia malayi	photoreceptor-specific nuclear receptor	0.0031	0.0293	0.0293
Onchocerca volvulus		0.0026	0.013	0.4418
Brugia malayi	nuclear receptor NHR-88	0.0031	0.0293	0.0293
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0031	0.0293	0.0293
Loa Loa (eye worm)	hypothetical protein	0.0306	1	1
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0132	0.3875	0.7382
Echinococcus multilocularis	lamin	0.0026	0.013	0.0204
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0031	0.0293	0.0461
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0031	0.0293	0.0293
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0031	0.0293	0.0293
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0031	0.0293	0.0461
Leishmania major	cytochrome p450-like protein	0.0023	0.0036	0.5
Echinococcus granulosus	arachidonate 5 lipoxygenase	0.0067	0.156	0.2452
Brugia malayi	ecdysteroid receptor	0.0031	0.0293	0.0293
Loa Loa (eye worm)	hypothetical protein	0.0048	0.0897	0.0897
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0203	0.6361	1
Schistosoma mansoni	polycystin 1-related	0.0024	0.0051	0.0096
Loa Loa (eye worm)	hypothetical protein	0.0132	0.3875	0.3875
Plasmodium vivax	multidomain scavenger receptor, putative	0.0024	0.0051	0.5
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0046	0.0842	0.0842
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0031	0.0293	0.0461
Schistosoma mansoni	thyroid hormone receptor	0.0031	0.0293	0.0559
Trichomonas vaginalis	spcc417.12 protein, putative	0.0022	0	0.5
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0046	0.0842	0.1324
Echinococcus granulosus	lamin dm0	0.0026	0.013	0.0204
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0031	0.0293	0.0461
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0031	0.0293	0.0461
Schistosoma mansoni	hypothetical protein	0.0024	0.0051	0.0096
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0046	0.0842	0.1604
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0151	0.4536	0.4536
Onchocerca volvulus	Bile acid receptor homolog	0.0031	0.0293	1
Brugia malayi	Carboxylesterase family protein	0.0132	0.3875	0.3875
Loa Loa (eye worm)	doublecortin family protein	0.0024	0.0051	0.0051
Echinococcus granulosus	geminin	0.0171	0.525	0.8253
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0031	0.0293	0.0293
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0031	0.0293	0.0461
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.028	0.9062	0.9062
Echinococcus multilocularis	geminin	0.0171	0.525	0.8253
Echinococcus multilocularis	Polycystic kidney disease protein	0.0024	0.0051	0.0079
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0031	0.0293	0.0293
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0031	0.0293	0.0461
Echinococcus granulosus	acetylcholinesterase	0.0132	0.3875	0.6093
Loa Loa (eye worm)	steroid hormone receptor	0.0031	0.0293	0.0293
Echinococcus multilocularis	acetylcholinesterase	0.0132	0.3875	0.6093
Schistosoma mansoni	hypothetical protein	0.0171	0.525	1
Trypanosoma cruzi	cytochrome P450, putative	0.0023	0.0036	0.5
Brugia malayi	Cytochrome P450 family protein	0.0023	0.0036	0.0036
Schistosoma mansoni	lamin	0.0026	0.013	0.0247
Schistosoma mansoni	intermediate filament proteins	0.0026	0.013	0.0247
Schistosoma mansoni	hypothetical protein	0.0171	0.525	1
Loa Loa (eye worm)	intermediate filament protein	0.0026	0.013	0.013
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0046	0.0842	0.1324
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0293	0.0293
Echinococcus multilocularis	lamin dm0	0.0026	0.013	0.0204
Trichomonas vaginalis	carboxylesterase domain containing protein, putative	0.0022	0	0.5
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0031	0.0293	0.0293
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0048	0.0897	0.0897
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0293	0.0293
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0031	0.0293	0.0293
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0031	0.0293	0.0461
Schistosoma mansoni	lipoxygenase	0.0024	0.0051	0.0096
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0031	0.0293	0.0559
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0031	0.0293	0.0559
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0031	0.0293	0.0461
Brugia malayi	hypothetical protein	0.0024	0.0051	0.0051
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0031	0.0293	0.0461
Echinococcus granulosus	RUN	0.0024	0.0051	0.0079
Loa Loa (eye worm)	CYP4Cod1	0.0023	0.0036	0.0036
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0031	0.0293	0.0461
Loa Loa (eye worm)	cytochrome P450 family protein	0.0036	0.0475	0.0475
Brugia malayi	steroid hormone receptor	0.0031	0.0293	0.0293
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0046	0.0842	0.1324
Echinococcus granulosus	lipoxygenase domain containing protein	0.0024	0.0051	0.0079
Onchocerca volvulus		0.0024	0.0051	0.1724
Schistosoma mansoni	hypothetical protein	0.0048	0.0897	0.1708
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0293	0.0293
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0048	0.0897	0.141
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0031	0.0293	1
Echinococcus granulosus	lamin	0.0026	0.013	0.0204
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0031	0.0293	0.0293
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0022	0	0.5
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0031	0.0293	0.0293
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0293	0.0293
Brugia malayi	follicle stimulating hormone receptor	0.028	0.9062	0.9062
Schistosoma mansoni	hypothetical protein	0.0103	0.2852	0.5432
Loa Loa (eye worm)	acetylcholinesterase 1	0.0132	0.3875	0.3875
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0031	0.0293	0.0293
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0048	0.0897	0.0897
Echinococcus multilocularis	arachidonate 5 lipoxygenase	0.0067	0.156	0.2452
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0031	0.0293	0.0293
Echinococcus multilocularis	FTZ F1 alpha	0.0031	0.0293	0.0461
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0031	0.0293	0.0559
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0151	0.4536	0.4536
Schistosoma mansoni	rab6-interacting	0.0024	0.0051	0.0096
Brugia malayi	hypothetical protein	0.0024	0.0051	0.0051
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0026	0.013	0.013
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0031	0.0293	0.0293
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0022	0	0.5
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0046	0.0842	0.1324
Trypanosoma cruzi	cytochrome P450, putative	0.0023	0.0036	0.5
Mycobacterium tuberculosis	Carboxylesterase LipT	0.0022	0	0.5
Echinococcus granulosus	GPCR family 2	0.0048	0.0897	0.141
Schistosoma mansoni	loxhd1	0.0024	0.0051	0.0096
Echinococcus multilocularis	carboxylesterase 5A	0.0132	0.3875	0.6093
Brugia malayi	Steroid receptor seven-up type 2	0.0031	0.0293	0.0293
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0031	0.0293	0.0293
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0031	0.0293	0.0461
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0031	0.0293	0.0293
Schistosoma mansoni	hypothetical protein	0.0048	0.0897	0.1708
Echinococcus multilocularis	ecdysone induced protein 78C	0.0031	0.0293	0.0461
Onchocerca volvulus	Protein ultraspiracle homolog	0.0031	0.0293	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0046	0.0842	0.1604
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0113	0.0113
Brugia malayi	Nuclear hormone receptor-like 1	0.0031	0.0293	0.0293
Echinococcus multilocularis	acetylcholinesterase	0.0132	0.3875	0.6093
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0031	0.0293	0.0559
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0293	0.0293
Schistosoma mansoni	lipoxygenase	0.0067	0.156	0.2971
Loa Loa (eye worm)	cytochrome P450 family protein	0.0023	0.0036	0.0036
Schistosoma mansoni	rab6-interacting	0.0024	0.0051	0.0096
Plasmodium falciparum	LCCL domain-containing protein	0.0024	0.0051	0.5
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0051	0.0051
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0046	0.0842	0.0842
Brugia malayi	Latrophilin receptor protein 2	0.0048	0.0897	0.0897
Loa Loa (eye worm)	hypothetical protein	0.0026	0.013	0.013
Loa Loa (eye worm)	hypothetical protein	0.0103	0.2852	0.2852
Schistosoma mansoni	retinoic acid receptor RXR	0.0031	0.0293	0.0559
Schistosoma mansoni	nuclear hormone receptor	0.0031	0.0293	0.0559
Onchocerca volvulus		0.0024	0.0051	0.1724
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0031	0.0293	0.0293
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0046	0.0842	0.1604
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0048	0.0897	0.141
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0203	0.6361	1
Brugia malayi	nuclear hormone receptor	0.0031	0.0293	0.0293
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0051	0.0051
Schistosoma mansoni	thyroid hormone receptor	0.0031	0.0293	0.0559
Brugia malayi	Intermediate filament tail domain containing protein	0.0026	0.013	0.013

Activities

Activity type	Activity value	Assay description	Source	Reference
AC50 (functional)		PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp2d6 Compounds with AC50 equal or less than 10 uM are considered active	ChEMBL.	No reference
AC50 (functional)		PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp2c9 Compounds with AC50 equal or less than 10 uM are considered active	ChEMBL.	No reference
AC50 (functional)	= 10 uM	PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp3a4 Compounds with AC50 equal or less than 10 uM are considered active	ChEMBL.	No reference
AC50 (functional)	= 12.58925412 uM	PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp1a2 Compounds with AC50 equal or less than 10 uM are considered active	ChEMBL.	No reference
AC50 (functional)	= 12.58925412 uM	PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp2c19 Compounds with AC50 equal or less than 10 uM are considered active	ChEMBL.	No reference
Potency (functional)	= 2.5119 um	PUBCHEM_BIOASSAY: qHTS Assay for Agonists of the Thyroid Stimulating Hormone Receptor. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 2.5119 um	PUBCHEM_BIOASSAY: qHTS Assay for Agonists of the Thyroid Stimulating Hormone Receptor: Activators of Intracellular cAMP Concentrations in Parental HEK 293. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 7.9433 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of 15-hLO (15-human lipoxygenase). (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (ADMET)	= 10 um	PUBCHEM_BIOASSAY: qHTS Assay for Activators of Cytochrome P450 3A4. (Class of assay: confirmatory) [Related pubchem assays: 410 ]	ChEMBL.	No reference
Potency (ADMET)	= 10 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors and Substrates of Cytochrome P450 3A4. (Class of assay: confirmatory) [Related pubchem assays: 410 ]	ChEMBL.	No reference
Potency (ADMET)	= 12.5893 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors and Substrates of Cytochrome P450 2C19. (Class of assay: confirmatory) [Related pubchem assays: 410 ]	ChEMBL.	No reference
Potency (functional)	= 25.1189 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of the ERK Signaling Pathway using a Homogeneous Screening Assay. (Class of assay: confirmatory)	ChEMBL.	No reference

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.

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External resources for this compound

ChEMBL: CHEMBL1592651

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1443700