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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: Q9UPY5
No. Gene UniProt ID Protein Name Pathway PDB
1 SLC7A11 Q9UPY5 Cystine/glutamate transporter hsa04216 NA


6 known interactions (drugs) of input target (SLC7A11): Cystine/glutamate transporter
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image
1 Approved;
Investigational		 SmallMoleculeDrug DB00740 Riluzole Thumb
2 Approved SmallMoleculeDrug DB00795 Sulfasalazine Thumb
3 Approved SmallMoleculeDrug DB11590 Thimerosal Thumb
4 Approved;
Investigational		 SmallMoleculeDrug DB06151 Acetylcysteine Thumb
5 Approved;
Nutraceutical		 SmallMoleculeDrug DB00142 Glutamic Acid Thumb
6 Approved;
Nutraceutical		 SmallMoleculeDrug DB00138 Cystine Thumb


20 predicted interactions (drugs) of input target (SLC7A11): Cystine/glutamate transporter
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image Confidence score
1 Approved;
Nutraceutical;
Vet approved		 SmallMoleculeDrug DB00145 Glycine Thumb 37.5%
2 Approved;
Investigational		 SmallMoleculeDrug DB00996 Gabapentin Thumb 34.6%
3 Approved SmallMoleculeDrug DB00898 Ethanol Thumb 33.7%
4 Approved SmallMoleculeDrug DB13146 Fluciclovine (18F) Thumb 32.7%
5 Approved;
Investigational		 SmallMoleculeDrug DB00555 Lamotrigine Thumb 31.3%
6 Approved;
Investigational;
Vet approved		 SmallMoleculeDrug DB00312 Pentobarbital Thumb 30.9%
7 Approved;
Investigational		 SmallMoleculeDrug DB06738 Ketobemidone Thumb 29.6%
8 Approved SmallMoleculeDrug DB00289 Atomoxetine Thumb 29.3%
9 Approved;
Investigational;
Nutraceutical		 SmallMoleculeDrug DB01708 Prasterone Thumb 29.1%
10 Approved;
Investigational		 SmallMoleculeDrug DB00659 Acamprosate Thumb 28.9%
11 Approved SmallMoleculeDrug DB00244 Mesalazine Thumb 28.8%
12 Approved;
Investigational		 SmallMoleculeDrug DB01174 Phenobarbital Thumb 27.9%
13 Approved SmallMoleculeDrug DB00233 Aminosalicylic Acid Thumb 27.6%
14 Approved;
Investigational		 SmallMoleculeDrug DB04896 Milnacipran Thumb 27.2%
15 Approved SmallMoleculeDrug DB01346 Quinidine barbiturate Thumb 26.1%
16 Approved SmallMoleculeDrug DB01173 Orphenadrine Thumb 25.9%
17 Approved;
Investigational		 SmallMoleculeDrug DB01043 Memantine Thumb 25.0%
18 Approved;
Nutraceutical		 SmallMoleculeDrug DB01956 Taurine Thumb 24.9%
19 Approved SmallMoleculeDrug DB00454 Pethidine Thumb 24.8%
20 Approved;
Nutraceutical		 SmallMoleculeDrug DB00157 NADH Thumb 24.8%


  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.