QuartataWeb
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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: Q99870
No. Gene UniProt ID Protein Name Pathway PDB
1 VMAT2 Q99870 Vesicle monoamine transporter type 2 NA NA


3 known interactions (drugs) of input target (VMAT2): Vesicle monoamine transporter type 2
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image
1 Approved;
Illicit;
Investigational		 SmallMoleculeDrug DB00182 Amphetamine Thumb
2 Approved;
Investigational		 SmallMoleculeDrug DB11915 Valbenazine Thumb
3 Approved;
Investigational		 SmallMoleculeDrug DB12010 Fostamatinib Thumb


20 predicted interactions (drugs) of input target (VMAT2): Vesicle monoamine transporter type 2
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image Confidence score
1 Approved;
Investigational		 SmallMoleculeDrug DB01593 Zinc Thumb 36.9%
2 Approved;
Nutraceutical		 SmallMoleculeDrug DB00157 NADH Thumb 28.1%
3 Approved;
Illicit		 SmallMoleculeDrug DB01576 Dextroamphetamine Thumb 26.6%
4 Approved;
Illicit		 SmallMoleculeDrug DB01577 Methamphetamine Thumb 26.3%
5 Approved;
Nutraceutical;
Withdrawn		 SmallMoleculeDrug DB01363 Ephedra Thumb 25.9%
6 Experimental SmallMoleculeDrug DB02010 Staurosporine Thumb 25.2%
7 Approved;
Investigational		 SmallMoleculeDrug DB09130 Copper Thumb 24.2%
8 Approved SmallMoleculeDrug DB00805 Minaprine Thumb 23.7%
9 Approved;
Investigational;
Vet approved		 SmallMoleculeDrug DB00477 Chlorpromazine Thumb 23.3%
10 Experimental SmallMoleculeDrug DB02733 Purvalanol Thumb 22.9%
11 Approved SmallMoleculeDrug DB00543 Amoxapine Thumb 22.7%
12 Approved;
Investigational;
Withdrawn		 SmallMoleculeDrug DB01041 Thalidomide Thumb 22.4%
13 Approved SmallMoleculeDrug DB00321 Amitriptyline Thumb 22.4%
14 Approved;
Investigational		 SmallMoleculeDrug DB09061 Cannabidiol Thumb 21.3%
15 Approved SmallMoleculeDrug DB00540 Nortriptyline Thumb 21.3%
16 Approved SmallMoleculeDrug DB00696 Ergotamine Thumb 21.0%
17 Approved;
Investigational		 SmallMoleculeDrug DB00555 Lamotrigine Thumb 21.0%
18 Experimental;
Illicit		 SmallMoleculeDrug DB01472 4-Methoxyamphetamine Thumb 20.9%
19 Approved;
Investigational		 SmallMoleculeDrug DB08912 Dabrafenib Thumb 20.7%
20 Approved SmallMoleculeDrug DB00852 Pseudoephedrine Thumb 20.6%


  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.