TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 214.175 | Formula: C8H10N2O5
H donors: 3 H acceptors: 4 LogP: -3.42 Rotable bonds: 2
Rule of 5 violations (Lipinski): 1
SMILES: OC(=O)C1=NO[C@H]2[C@@H]1C[C@@](C2)(N)C(=O)O
InChi: 1S/C8H10N2O5/c9-8(7(13)14)1-3-4(2-8)15-10-5(3)6(11)12/h3-4H,1-2,9H2,(H,11,12)(H,13,14)/t3-,4+,8-/m0/s1
InChiKey: NTVFQKSMRLANLZ-FXLGRURVSA-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

Species	Target name	Source	Bibliographic reference
Rattus norvegicus	Glutamate NMDA receptor	Starlite/ChEMBL	References

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
Toxoplasma gondii	protein kinase, putative	0.0297	0.504	1
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0105	0.1682	1
Schistosoma mansoni	glucose transport protein	0.0105	0.1682	1
Trypanosoma brucei	glucose transporter, putative	0.0033	0.0414	0.8107
Echinococcus multilocularis	solute carrier family 22	0.0015	0.0102	0.0605
Mycobacterium leprae	Possible lysyl-tRNA synthetase 2 LysX	0.0023	0.0254	0.3046
Trypanosoma brucei	glucose transporter, putative	0.0033	0.0414	0.8107
Trypanosoma brucei	glucose transporter 1E	0.0033	0.0414	0.8107
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0032	0.0406	0.2415
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0102	0.0605
Trichomonas vaginalis	lysyl-tRNA synthetase, putative	0.0023	0.0254	0.0961
Plasmodium falciparum	calcium-dependent protein kinase 4	0.0032	0.0407	0.0404
Mycobacterium ulcerans	glutamine-binding lipoprotein GlnH	0.0023	0.0245	0.0208
Onchocerca volvulus		0.0015	0.0102	0.5
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0406	0.2415
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0102	0.0605
Brugia malayi	hypothetical protein	0.0015	0.0102	0.0605
Trichomonas vaginalis	CAMK family protein kinase	0.0032	0.0406	0.1927
Echinococcus granulosus	Glutamate receptor ionotropic kainate 2	0.0014	0.008	0.0478
Mycobacterium leprae	Probable prolyl tRNA synthetase ProS	0.0032	0.0395	1
Toxoplasma gondii	cell-cycle-associated protein kinase MAPK, putative	0.017	0.2815	0.5495
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0105	0.1682	1
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0033	0.0414	0.8107
Onchocerca volvulus		0.0015	0.0102	0.5
Plasmodium vivax	calcium-dependent protein kinase 3, putative	0.0032	0.0407	0.0404
Leishmania major	prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative	0.0037	0.0486	1
Plasmodium falciparum	calcium-dependent protein kinase 5	0.0032	0.0407	0.0404
Trichomonas vaginalis	conserved hypothetical protein	0.0033	0.0414	0.1973
Leishmania major	lysyl-tRNA synthetase, putative	0.0023	0.0254	0.395
Trypanosoma brucei	glucose transporter, putative	0.0033	0.0414	0.8107
Plasmodium vivax	calcium-dependent protein kinase 1, putative	0.0032	0.0407	0.0404
Echinococcus multilocularis	lysyl tRNA synthetase	0.0023	0.0254	0.1508
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0033	0.0414	0.8107
Toxoplasma gondii	prolyl-tRNA synthetase (ProRS)	0.0037	0.0486	0.0779
Giardia lamblia	Lysyl-tRNA synthetase	0.0023	0.0254	0.5182
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0291	0.1732
Giardia lamblia	Prolyl-tRNA synthetase	0.0032	0.0395	1
Schistosoma mansoni	serine/threonine protein kinase	0.0032	0.0406	0.2415
Echinococcus granulosus	glutamate receptor 2	0.0014	0.008	0.0478
Leishmania major	prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative	0.0037	0.0486	1
Toxoplasma gondii	calcium-dependent protein kinase CDPK2B	0.0032	0.0407	0.0617
Trypanosoma cruzi	prolyl-tRNA synthetase, putative	0.0037	0.0486	1
Brugia malayi	Sugar transporter family protein	0.0015	0.0102	0.0605
Mycobacterium tuberculosis	Lysyl-tRNA synthetase 2 LysX	0.002	0.0192	0.0091
Onchocerca volvulus		0.0015	0.0102	0.5
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0032	0.0406	0.2415
Schistosoma mansoni	glutamate receptor NMDA	0.0014	0.008	0.0478
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0105	0.1682	1
Brugia malayi	Cam kinase protein 1	0.0032	0.0406	0.2415
Echinococcus multilocularis	solute carrier family 22	0.0015	0.0102	0.0605
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0032	0.0406	0.2415
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0105	0.1682	1
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0102	0.0605
Echinococcus multilocularis	Sugar transporter ERD6 protein	0.0015	0.0102	0.0605
Echinococcus granulosus	Glutamate receptor ionotropic kainate 2	0.0014	0.008	0.0478
Schistosoma mansoni	protein kinase	0.0032	0.0406	0.2415
Toxoplasma gondii	facilitative glucose transporter GT1	0.0105	0.1682	0.3201
Trichomonas vaginalis	sugar transporter, putative	0.0033	0.0414	0.1973
Echinococcus granulosus	solute carrier family 22	0.0015	0.0102	0.0605
Onchocerca volvulus		0.0015	0.0102	0.5
Echinococcus granulosus	lysyl tRNA synthetase	0.0023	0.0254	0.1508
Loa Loa (eye worm)	sugar transporter	0.0015	0.0102	0.0605
Toxoplasma gondii	lysine-tRNA ligase	0.0023	0.0254	0.0308
Treponema pallidum	amino acid ABC transporter, periplasmic binding protein	0.0023	0.0245	1
Plasmodium vivax	proline--tRNA ligase, putative	0.0037	0.0486	0.051
Plasmodium falciparum	hexose transporter	0.0105	0.1682	0.2094
Onchocerca volvulus		0.0015	0.0102	0.5
Mycobacterium ulcerans	fusion protein of transposase for IS2606 and sialic acid-transport integral membrane protein NanT	0.0015	0.0102	0.0064
Echinococcus granulosus	solute carrier family 22	0.0015	0.0102	0.0605
Trypanosoma brucei	glucose transporter, putative	0.0033	0.0414	0.8107
Brugia malayi	Major Facilitator Superfamily protein	0.0015	0.0102	0.0605
Brugia malayi	Sugar transporter family protein	0.0105	0.1682	1
Echinococcus multilocularis	nmda type glutamate receptor	0.0032	0.0402	0.239
Trypanosoma brucei	glucose transporter, putative	0.0033	0.0414	0.8107
Trichomonas vaginalis	conserved hypothetical protein	0.0105	0.1682	1
Schistosoma mansoni	glucose transport protein	0.0105	0.1682	1
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0102	0.0605
Brugia malayi	bifunctional aminoacyl-tRNA synthetase	0.0032	0.0395	0.2347
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0102	0.0605
Trypanosoma cruzi	prolyl-tRNA synthetase, putative	0.0037	0.0486	1
Plasmodium falciparum	protein kinase 7	0.0297	0.504	0.6542
Loa Loa (eye worm)	CAMK/CAMK2 protein kinase	0.0032	0.0406	0.2415
Echinococcus granulosus	solute carrier family 22	0.0015	0.0102	0.0605
Trypanosoma cruzi	hexose transporter, putative	0.0033	0.0414	0.8107
Trypanosoma cruzi	hexose transporter, putative	0.0033	0.0414	0.8107
Plasmodium falciparum	protein kinase 6	0.0446	0.765	1
Plasmodium vivax	mitogen-activated protein kinase 2, putative	0.017	0.2815	0.3595
Trichomonas vaginalis	glucose transporter, putative	0.0033	0.0414	0.1973
Loa Loa (eye worm)	calcium/calmodulin-dependent protein kinase ID	0.0032	0.0406	0.2415
Echinococcus multilocularis	glutamyl tRNA synthetase cytoplasmic	0.0032	0.0395	0.2347
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0105	0.1682	1
Plasmodium vivax	CDK-related protein kinase 6, putative	0.0446	0.765	1
Echinococcus granulosus	nmda type glutamate receptor	0.0032	0.0402	0.239
Echinococcus granulosus	Glutamate receptor ionotropic kainate 2	0.0014	0.008	0.0478
Mycobacterium ulcerans	sugar-transport integral membrane protein SugI	0.0015	0.0102	0.0064
Trichomonas vaginalis	sugar transporter, putative	0.0033	0.0414	0.1973
Echinococcus multilocularis	Glutamate receptor, ionotropic kainate 3	0.0032	0.0402	0.239
Chlamydia trachomatis	glutamine binding protein	0.0023	0.0245	0.9606
Echinococcus granulosus	Sugar transporter ERD6 protein	0.0015	0.0102	0.0605
Mycobacterium ulcerans	integral membrane transport protein	0.0015	0.0102	0.0064
Onchocerca volvulus		0.0015	0.0102	0.5
Schistosoma mansoni	sugar transporter	0.0015	0.0102	0.0605
Mycobacterium tuberculosis	Lysyl-tRNA synthetase 1 LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase)	0.002	0.0192	0.0091
Schistosoma mansoni	hypothetical protein	0.0105	0.1682	1
Mycobacterium ulcerans	lysyl-tRNA synthetase	0.0023	0.0254	0.0216
Echinococcus granulosus	solute carrier family 22	0.0015	0.0102	0.0605
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0032	0.0406	0.2415
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0395	0.2347
Plasmodium vivax	calcium-dependent protein kinase 4, putative	0.0032	0.0407	0.0404
Trypanosoma brucei	glucose transporter, putative	0.0033	0.0414	0.8107
Onchocerca volvulus		0.0015	0.0102	0.5
Brugia malayi	Bifunctional aminoacyl-tRNA synthetase	0.0032	0.0395	0.2347
Brugia malayi	hypothetical protein	0.0015	0.0102	0.0605
Trichomonas vaginalis	lysyl-tRNA synthetase, putative	0.0021	0.0203	0.0641
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0395	0.2347
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type 1	0.0032	0.0406	0.2415
Schistosoma mansoni	glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs)	0.0032	0.0395	0.2347
Loa Loa (eye worm)	major facilitator superfamily transporter	0.0015	0.0102	0.0605
Plasmodium falciparum	calcium-dependent protein kinase 1	0.0032	0.0407	0.0404
Echinococcus multilocularis	Glutamate receptor, ionotropic kainate 2	0.0014	0.008	0.0478
Leishmania major	protein kinase, putative	0.0032	0.0406	0.7919
Schistosoma mansoni	protein kinase	0.0032	0.0406	0.2415
Plasmodium vivax	lysine--tRNA ligase, putative	0.0023	0.0254	0.0201
Echinococcus granulosus	General substrate transporter	0.009	0.1424	0.8463
Plasmodium falciparum	lysine--tRNA ligase	0.0023	0.0254	0.0201
Trypanosoma brucei	lysyl-tRNA synthetase, putative	0.0023	0.0254	0.395
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0102	0.0605
Brugia malayi	Calcium/calmodulin-dependent protein kinase type II alpha chain	0.0032	0.0406	0.2415
Echinococcus multilocularis	Glutamate receptor, ionotropic kainate 2	0.0014	0.008	0.0478
Echinococcus multilocularis	General substrate transporter	0.009	0.1424	0.8463
Mycobacterium tuberculosis	Probable glutamine-binding lipoprotein GlnH (GLNBP)	0.0023	0.0245	0.0145
Toxoplasma gondii	calcium-dependent protein kinase CDPK2A	0.0032	0.0407	0.0617
Loa Loa (eye worm)	bifunctional aminoacyl-tRNA synthetase	0.0013	0.007	0.0414
Entamoeba histolytica	protein kinase, putative	0.0032	0.0406	1
Schistosoma mansoni	glucose transporter	0.0015	0.0102	0.0605
Onchocerca volvulus		0.0015	0.0102	0.5
Onchocerca volvulus		0.0015	0.0102	0.5
Schistosoma mansoni	lysyl-tRNA synthetase	0.0023	0.0254	0.1508
Echinococcus granulosus	glutamyl tRNA synthetase cytoplasmic	0.0032	0.0395	0.2347
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0102	0.0605
Onchocerca volvulus		0.0015	0.0102	0.5
Echinococcus multilocularis	calcium dependent protein kinase	0.003	0.0372	0.2208
Trypanosoma brucei	glucose transporter, putative	0.0033	0.0414	0.8107
Brugia malayi	major facilitator superfamily protein	0.0015	0.0102	0.0605
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0102	0.0605
Onchocerca volvulus		0.0015	0.0102	0.5
Schistosoma mansoni	sugar transporter	0.0015	0.0102	0.0605
Echinococcus multilocularis	glutamate receptor 2	0.0014	0.008	0.0478
Trichomonas vaginalis	sugar transporter, putative	0.0033	0.0414	0.1973
Leishmania major	glucose transporter/membrane transporter D2, putative	0.0033	0.0414	0.8107
Trichomonas vaginalis	glucose transporter, putative	0.0033	0.0414	0.1973
Echinococcus multilocularis	solute carrier family 22	0.0015	0.0102	0.0605
Plasmodium falciparum	calcium-dependent protein kinase 3	0.0032	0.0407	0.0404
Toxoplasma gondii	calcium-dependent protein kinase CDPK3	0.0032	0.0407	0.0617
Loa Loa (eye worm)	major facilitator superfamily transporter	0.0015	0.0102	0.0605
Schistosoma mansoni	sugar transporter	0.0015	0.0102	0.0605
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0032	0.0406	0.2415
Mycobacterium ulcerans	sugar transporter	0.0015	0.0102	0.0064
Onchocerca volvulus		0.0015	0.0102	0.5
Wolbachia endosymbiont of Brugia malayi	major facilitator superfamily permease	0.0015	0.0102	0.5
Echinococcus granulosus	synaptic vesicle 2 protein	0.0015	0.0102	0.0605
Trypanosoma cruzi	lysyl-tRNA synthetase, putative	0.0023	0.0254	0.395
Schistosoma mansoni	glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs)	0.0032	0.0395	0.2347
Entamoeba histolytica	protein kinase, putative	0.0032	0.0406	1
Schistosoma mansoni	glucose transport protein	0.0105	0.1682	1
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0032	0.0406	0.2415
Plasmodium vivax	calcium-dependent protein kinase, putative	0.0032	0.0407	0.0404
Onchocerca volvulus		0.0015	0.0102	0.5
Chlamydia trachomatis	arginine ABC transporter substrate-binding protein ArtJ	0.0023	0.0245	0.9606
Trypanosoma brucei	glucose transporter 2A	0.0033	0.0414	0.8107
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0102	0.0605
Trypanosoma brucei	glucose transporter, putative	0.0033	0.0414	0.8107
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0102	0.0605
Schistosoma mansoni	sugar transporter	0.0015	0.0102	0.0605
Echinococcus multilocularis	solute carrier family 2, facilitated glucose	0.0105	0.1682	1
Brugia malayi	Major Facilitator Superfamily protein	0.0015	0.0102	0.0605
Mycobacterium ulcerans	short chain dehydrogenase	0.0581	1	1
Chlamydia trachomatis	lysine--tRNA ligase	0.0023	0.0254	1
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0102	0.0605
Trypanosoma brucei	bifunctional aminoacyl-tRNA synthetase, putative	0.0037	0.0486	1
Echinococcus granulosus	glutamate receptor ionotrophic AMPA 3	0.0014	0.008	0.0478
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0032	0.0406	0.2415
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0105	0.1682	1
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0102	0.0605
Trichomonas vaginalis	conserved hypothetical protein	0.0033	0.0414	0.1973
Mycobacterium ulcerans	lysyl-tRNA synthetase	0.0023	0.0254	0.0216
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0254	0.1508
Schistosoma mansoni	protein kinase	0.0032	0.0406	0.2415
Treponema pallidum	amino acid ABC transporter, periplasmic binding protein (hisJ)	0.0023	0.0245	1
Brugia malayi	hypothetical protein	0.0015	0.0102	0.0605
Plasmodium falciparum	proline--tRNA ligase	0.0037	0.0486	0.051
Echinococcus multilocularis	glutamate receptor, ionotrophic, AMPA 3	0.0014	0.008	0.0478
Loa Loa (eye worm)	sugar transporter	0.0105	0.1682	1
Trypanosoma cruzi	hexose transporter, putative	0.0018	0.0155	0.1383
Brugia malayi	Sugar transporter family protein	0.0015	0.0102	0.0605
Leishmania major	glucose transporter, lmgt1	0.0033	0.0414	0.8107
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0102	0.0605
Plasmodium falciparum	mitogen-activated protein kinase 2	0.017	0.2815	0.3595
Brugia malayi	Major Facilitator Superfamily protein	0.0015	0.0102	0.0605
Brugia malayi	major facilitator superfamily protein	0.0015	0.0102	0.0605
Schistosoma mansoni	lysyl-tRNA synthetase	0.0023	0.0254	0.1508
Echinococcus multilocularis	solute carrier family 22	0.0015	0.0102	0.0605
Onchocerca volvulus		0.0015	0.0102	0.5
Echinococcus multilocularis	Glutamate receptor, ionotropic kainate 2	0.0014	0.008	0.0478
Trypanosoma cruzi	hexose transporter	0.0033	0.0414	0.8107
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0102	0.0605
Onchocerca volvulus		0.0015	0.0102	0.5
Brugia malayi	lysyl-tRNA synthetase	0.0023	0.0254	0.1508
Plasmodium vivax	hexose transporter	0.0105	0.1682	0.2094
Entamoeba histolytica	prolyl-tRNA synthetase, putative	0.0032	0.0395	0.9253
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0102	0.0605
Echinococcus multilocularis	synaptic vesicle 2 protein	0.0015	0.0102	0.0605
Onchocerca volvulus	Putative transporter	0.0015	0.0102	0.5
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0105	0.1682	1
Leishmania major	glucose transporter, lmgt3	0.0033	0.0414	0.8107
Trypanosoma brucei	calcium/calmodulin-dependent protein kinase, putative	0.0032	0.0406	0.7919
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0033	0.0414	0.8107
Trichomonas vaginalis	prolyl-tRNA synthetase, putative	0.0032	0.0395	0.1855
Echinococcus granulosus	calcium dependent protein kinase	0.003	0.0372	0.2208
Plasmodium falciparum	calcium-dependent protein kinase 2	0.0032	0.0407	0.0404
Trypanosoma cruzi	hexose transporter, putative	0.0033	0.0414	0.8107
Schistosoma mansoni	nuclear transcription factor X-box binding 1 (nfx1)	0.0015	0.0102	0.0605
Leishmania major	glucose transporter, lmgt2	0.0033	0.0414	0.8107
Onchocerca volvulus		0.0015	0.0102	0.5

Activities

Activity type	Activity value	Assay description	Source	Reference
EC50 (binding)	> 1000 uM	Effective concentration against mGluR1 receptor expressed in CHO cells	ChEMBL.	16190758
EC50 (binding)	> 1000 uM	Effective concentration against mGluR2 receptor expressed in CHO cells	ChEMBL.	16190758
EC50 (binding)	> 1000 uM	Effective concentration against mGluR4 receptor expressed in CHO cells	ChEMBL.	16190758
EC50 (binding)	> 1000 uM	Effective concentration against mGluR1 receptor expressed in CHO cells	ChEMBL.	16190758
EC50 (binding)	> 1000 uM	Effective concentration against mGluR2 receptor expressed in CHO cells	ChEMBL.	16190758
EC50 (binding)	> 1000 uM	Effective concentration against mGluR4 receptor expressed in CHO cells	ChEMBL.	16190758
IC50 (binding)	> 100 uM	In vitro inhibitory concentration against AMPA receptor using [3H]-AMPA	ChEMBL.	16190758
IC50 (binding)	> 100 uM	In vitro inhibitory concentration against KA receptor using [3H]-KA	ChEMBL.	16190758
IC50 (binding)	> 100 uM	In vitro inhibitory concentration against AMPA receptor using [3H]-AMPA	ChEMBL.	16190758
IC50 (binding)	> 100 uM	In vitro inhibitory concentration against KA receptor using [3H]-KA	ChEMBL.	16190758
Ki (binding)	= 0.233 uM	In vitro binding affinity for NMDA receptor using [3H]-CGP- 39653	ChEMBL.	16190758
Ki (binding)	= 0.233 uM	In vitro binding affinity for NMDA receptor using [3H]-CGP- 39653	ChEMBL.	16190758
Ki (binding)	> 1000 uM	Binding affinity for mGluR1 receptor expressed in CHO cells	ChEMBL.	16190758
Ki (binding)	> 1000 uM	Binding affinity for mGluR2 receptor expressed in CHO cells	ChEMBL.	16190758
Ki (binding)	> 1000 uM	Binding affinity for mGluR4 receptor expressed in CHO cells	ChEMBL.	16190758
Ki (binding)	> 1000 uM	Binding affinity for mGluR1 receptor expressed in CHO cells	ChEMBL.	16190758
Ki (binding)	> 1000 uM	Binding affinity for mGluR2 receptor expressed in CHO cells	ChEMBL.	16190758
Ki (binding)	> 1000 uM	Binding affinity for mGluR4 receptor expressed in CHO cells	ChEMBL.	16190758

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: CHEMBL415461

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 342844