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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: P52209
No. Gene UniProt ID Protein Name Pathway PDB
1 PGD P52209 6-phosphogluconate dehydrogenase, decarboxylating hsa00030; hsa00480; hsa01100; hsa01200 2JKV; 4GWG; 4GWK

5 known interactions (drugs) of input target (PGD): 6-phosphogluconate dehydrogenase, decarboxylating
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter
1 Experimental SmallMoleculeDrug DB03962 Nicotinamide 8-Bromo-Adenine Dinucleotide Phosphate Thumb
2 Approved SmallMoleculeDrug DB00789 Gadopentetate dimeglumine Thumb
3 Experimental SmallMoleculeDrug DB02076 6-phospho-D-gluconic acid Thumb
4 Approved;
SmallMoleculeDrug DB00851 Dacarbazine Thumb
5 Approved SmallMoleculeDrug DB00920 Ketotifen Thumb

20 predicted interactions (drugs) of input target (PGD): 6-phosphogluconate dehydrogenase, decarboxylating
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter
Image Confidence score
1 Approved;
SmallMoleculeDrug DB00142 Glutamic Acid Thumb 28.7%
2 Approved;
SmallMoleculeDrug DB00786 Marimastat Thumb 27.9%
3 Experimental SmallMoleculeDrug DB04141 2-Hexyloxy-6-Hydroxymethyl-Tetrahydro-Pyran-3,4,5-Triol Thumb 23.8%
4 Approved;
SmallMoleculeDrug DB01043 Memantine Thumb 22.7%
5 Approved;
SmallMoleculeDrug DB00714 Apomorphine Thumb 22.3%
6 Approved;
SmallMoleculeDrug DB00555 Lamotrigine Thumb 22.2%
7 Approved;
SmallMoleculeDrug DB00139 Succinic acid Thumb 21.8%
8 Approved;
Vet approved
SmallMoleculeDrug DB00420 Promazine Thumb 21.4%
9 Approved SmallMoleculeDrug DB05271 Rotigotine Thumb 21.1%
10 Approved;
SmallMoleculeDrug DB09289 Tianeptine Thumb 20.8%
11 Investigational SmallMoleculeDrug DB06229 Ocaperidone Thumb 20.4%
12 Investigational SmallMoleculeDrug DB06678 Esmirtazapine Thumb 20.4%
13 Experimental SmallMoleculeDrug DB03814 2-(N-Morpholino)-Ethanesulfonic Acid Thumb 20.2%
14 Approved SmallMoleculeDrug DB00273 Topiramate Thumb 19.7%
15 Approved SmallMoleculeDrug DB00726 Trimipramine Thumb 19.7%
16 Investigational;
SmallMoleculeDrug DB08839 Serotonin Thumb 19.4%
17 Approved;
SmallMoleculeDrug DB01942 Formic Acid Thumb 19.3%
18 Approved;
SmallMoleculeDrug DB14185 Aripiprazole lauroxil Thumb 19.0%
19 Approved;
SmallMoleculeDrug DB01624 Zuclopenthixol Thumb 18.9%
20 Approved;
Vet approved
SmallMoleculeDrug DB00797 Tolazoline Thumb 18.9%


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.


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.