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Network of interactions between drugs (red spheres) and targets (blue spheres) is displayed above.
The red lines are used for the predicted interactions and the thickness of edges indicate the confidence score of predictions.

Data source: DrugBank-all; Query type: target; # of requested predictions: 20; Secondary interactions: no
Input target 1: O15399
No. Gene UniProt ID Protein Name Pathway PDB
1 GRIN2D O15399 Glutamate receptor ionotropic, NMDA 2D hsa04020; hsa04024; hsa04080; hsa04713; hsa04720; hsa04724; hsa05010; hsa05014; hsa05030; hsa05031; hsa05033; hsa05034 NA


18 known interactions (drugs) of input target (GRIN2D): Glutamate receptor ionotropic, NMDA 2D
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image
1 Approved;
Investigational		 SmallMoleculeDrug DB00659 Acamprosate Thumb
2 Approved SmallMoleculeDrug DB00454 Pethidine Thumb
3 Approved;
Investigational		 SmallMoleculeDrug DB06738 Ketobemidone Thumb
4 Approved;
Investigational		 SmallMoleculeDrug DB01174 Phenobarbital Thumb
5 Approved SmallMoleculeDrug DB13146 Fluciclovine (18F) Thumb
6 Approved SmallMoleculeDrug DB01173 Orphenadrine Thumb
7 Approved;
Investigational		 SmallMoleculeDrug DB00996 Gabapentin Thumb
8 Approved;
Investigational;
Nutraceutical		 SmallMoleculeDrug DB01708 Prasterone Thumb
9 Approved SmallMoleculeDrug DB00289 Atomoxetine Thumb
10 Approved SmallMoleculeDrug DB09409 Magnesium acetate tetrahydrate Thumb
11 Approved;
Investigational		 SmallMoleculeDrug DB06151 Acetylcysteine Thumb
12 Approved;
Vet approved		 SmallMoleculeDrug DB00418 Secobarbital Thumb
13 Investigational SmallMoleculeDrug DB06741 Gavestinel Thumb
14 Approved;
Investigational		 SmallMoleculeDrug DB09481 Magnesium carbonate Thumb
15 Approved;
Investigational;
Vet approved		 SmallMoleculeDrug DB00312 Pentobarbital Thumb
16 Experimental;
Illicit;
Investigational		 SmallMoleculeDrug DB01520 Tenocyclidine Thumb
17 Approved;
Investigational		 SmallMoleculeDrug DB04896 Milnacipran Thumb
18 Approved;
Nutraceutical		 SmallMoleculeDrug DB00142 Glutamic Acid Thumb


20 predicted interactions (drugs) of input target (GRIN2D): Glutamate receptor ionotropic, NMDA 2D
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image Confidence score
1 Approved;
Vet approved		 SmallMoleculeDrug DB01159 Halothane Thumb 73.0%
2 Approved;
Investigational		 SmallMoleculeDrug DB01043 Memantine Thumb 71.4%
3 Approved SmallMoleculeDrug DB00949 Felbamate Thumb 69.7%
4 Approved;
Investigational;
Withdrawn		 SmallMoleculeDrug DB08954 Ifenprodil Thumb 65.6%
5 Approved;
Nutraceutical		 SmallMoleculeDrug DB01956 Taurine Thumb 62.8%
6 Approved;
Nutraceutical;
Vet approved		 SmallMoleculeDrug DB00145 Glycine Thumb 54.9%
7 Experimental SmallMoleculeDrug DB01931 Dcka, 5,7-Dichlorokynurenic Acid Thumb 46.8%
8 Investigational SmallMoleculeDrug DB05956 EVT-101 Thumb 46.3%
9 Approved;
Experimental;
Investigational		 SmallMoleculeDrug DB03929 D-Serine Thumb 46.3%
10 Experimental SmallMoleculeDrug DB04620 Cycloleucine Thumb 45.2%
11 Experimental;
Investigational		 SmallMoleculeDrug DB08838 Agmatine Thumb 45.2%
12 Approved SmallMoleculeDrug DB00898 Ethanol Thumb 42.1%
13 Investigational SmallMoleculeDrug DB05824 CNS-5161 Thumb 41.5%
14 Approved SmallMoleculeDrug DB00502 Haloperidol Thumb 40.8%
15 Approved SmallMoleculeDrug DB00915 Amantadine Thumb 40.8%
16 Approved SmallMoleculeDrug DB00392 Ethopropazine Thumb 40.0%
17 Approved;
Illicit		 SmallMoleculeDrug DB01352 Aprobarbital Thumb 39.7%
18 Approved;
Vet approved		 SmallMoleculeDrug DB00599 Thiopental Thumb 38.8%
19 Approved;
Investigational		 SmallMoleculeDrug DB00193 Tramadol Thumb 38.2%
20 Illicit SmallMoleculeDrug DB01483 Barbital Thumb 37.1%


  logl

Reference:  Hongchun Li, Fen Pei, D. Lansing Taylor and Ivet Bahar. (2020) QuartataWeb: Integrated Chemical–Protein-Pathway Mapping for Polypharmacology and Chemogenomics. Bioinformatics 36(12), 3935–3937.

Contact:

The QuartataWeb server is maintained by the Bahar Lab at the Department of Computational & Systems Biology at the University of Pittsburgh, School of Medicine, and sponsored by the NIH awards P41 GM103712 and P01 DK096990; and by the Li Lab at Research Center for Computer-Aided Drug Discovery at Shenzhen Institutes of Advanced Technology, CAS.

For questions and comments please contact Hongchun Li.