QuartataWeb
Home  |   About  |   Theory  |   Tutorials  |   FAQ  |   Bahar Lab  |   Statistics
 

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: Q13002
No. Gene UniProt ID Protein Name Pathway PDB
1 GRIK2 Q13002 Glutamate receptor ionotropic, kainate 2 hsa04080; hsa04724 3QXM


21 known interactions (drugs) of input target (GRIK2): Glutamate receptor ionotropic, kainate 2
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image
1 Experimental SmallMoleculeDrug DB03425 2s,4r-4-Methylglutamate Thumb
2 Approved;
Illicit		 SmallMoleculeDrug DB00237 Butabarbital Thumb
3 Approved SmallMoleculeDrug DB01354 Heptabarbital Thumb
4 Experimental SmallMoleculeDrug DB02999 Quisqualate Thumb
5 Approved;
Illicit		 SmallMoleculeDrug DB01352 Aprobarbital Thumb
6 Approved;
Illicit		 SmallMoleculeDrug DB01353 Butethal Thumb
7 Approved;
Illicit		 SmallMoleculeDrug DB01351 Amobarbital Thumb
8 Approved;
Vet approved		 SmallMoleculeDrug DB00418 Secobarbital Thumb
9 Experimental SmallMoleculeDrug DB02852 Domoic Acid Thumb
10 Withdrawn SmallMoleculeDrug DB00463 Metharbital Thumb
11 Approved;
Illicit		 SmallMoleculeDrug DB00241 Butalbital Thumb
12 Illicit SmallMoleculeDrug DB01483 Barbital Thumb
13 Approved;
Vet approved		 SmallMoleculeDrug DB00794 Primidone Thumb
14 Approved SmallMoleculeDrug DB00849 Methylphenobarbital Thumb
15 Experimental;
Illicit		 SmallMoleculeDrug DB01496 Barbituric acid derivative Thumb
16 Approved SmallMoleculeDrug DB01355 Hexobarbital Thumb
17 Approved;
Investigational;
Vet approved		 SmallMoleculeDrug DB00312 Pentobarbital Thumb
18 Approved;
Nutraceutical		 SmallMoleculeDrug DB00142 Glutamic Acid Thumb
19 Approved;
Illicit		 SmallMoleculeDrug DB00306 Talbutal Thumb
20 Approved;
Vet approved		 SmallMoleculeDrug DB00599 Thiopental Thumb
21 Approved;
Investigational		 SmallMoleculeDrug DB01174 Phenobarbital Thumb


20 predicted interactions (drugs) of input target (GRIK2): Glutamate receptor ionotropic, kainate 2
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image Confidence score
1 Approved;
Investigational		 SmallMoleculeDrug DB00659 Acamprosate Thumb 78.6%
2 Approved;
Investigational;
Nutraceutical		 SmallMoleculeDrug DB01708 Prasterone Thumb 71.7%
3 Approved SmallMoleculeDrug DB01346 Quinidine barbiturate Thumb 69.2%
4 Approved;
Vet approved		 SmallMoleculeDrug DB01159 Halothane Thumb 66.1%
5 Approved SmallMoleculeDrug DB00898 Ethanol Thumb 65.9%
6 Approved;
Nutraceutical		 SmallMoleculeDrug DB01956 Taurine Thumb 65.5%
7 Approved SmallMoleculeDrug DB00292 Etomidate Thumb 63.6%
8 Approved;
Illicit		 SmallMoleculeDrug DB01588 Prazepam Thumb 62.3%
9 Investigational SmallMoleculeDrug DB05087 Ganaxolone Thumb 61.1%
10 Approved;
Illicit		 SmallMoleculeDrug DB01589 Quazepam Thumb 60.9%
11 Approved;
Illicit		 SmallMoleculeDrug DB00371 Meprobamate Thumb 60.6%
12 Approved;
Illicit		 SmallMoleculeDrug DB01437 Glutethimide Thumb 60.5%
13 Approved;
Vet approved		 SmallMoleculeDrug DB00753 Isoflurane Thumb 60.5%
14 Approved;
Illicit;
Withdrawn		 SmallMoleculeDrug DB00801 Halazepam Thumb 60.2%
15 Investigational SmallMoleculeDrug DB06579 Adipiplon Thumb 60.1%
16 Approved;
Illicit;
Investigational		 SmallMoleculeDrug DB01558 Bromazepam Thumb 60.1%
17 Approved;
Illicit		 SmallMoleculeDrug DB01068 Clonazepam Thumb 59.9%
18 Experimental SmallMoleculeDrug DB13983 5,7,2′-trihydroxy-6,8-dimethoxyflavone Thumb 59.9%
19 Approved;
Illicit;
Investigational		 SmallMoleculeDrug DB00404 Alprazolam Thumb 59.8%
20 Approved;
Illicit		 SmallMoleculeDrug DB01215 Estazolam Thumb 59.8%


  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.