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: Q9UK17
No. Gene UniProt ID Protein Name Pathway PDB
1 KCND3 Q9UK17 Potassium voltage-gated channel subfamily D member 3 NA 1S1G; 2NZ0


6 known interactions (drugs) of input target (KCND3): Potassium voltage-gated channel subfamily D member 3
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image
1 Approved SmallMoleculeDrug DB00458 Imipramine Thumb
2 Approved SmallMoleculeDrug DB00321 Amitriptyline Thumb
3 Approved;
Investigational		 SmallMoleculeDrug DB11633 Isavuconazole Thumb
4 Approved SmallMoleculeDrug DB00280 Disopyramide Thumb
5 Approved SmallMoleculeDrug DB06637 Dalfampridine Thumb
6 Approved;
Investigational		 SmallMoleculeDrug DB06217 Vernakalant Thumb


20 predicted interactions (drugs) of input target (KCND3): Potassium voltage-gated channel subfamily D member 3
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image Confidence score
1 Approved SmallMoleculeDrug DB00661 Verapamil Thumb 51.1%
2 Approved;
Investigational;
Vet approved		 SmallMoleculeDrug DB00477 Chlorpromazine Thumb 44.0%
3 Approved SmallMoleculeDrug DB00726 Trimipramine Thumb 42.4%
4 Approved;
Investigational		 SmallMoleculeDrug DB00934 Maprotiline Thumb 41.7%
5 Approved;
Investigational		 SmallMoleculeDrug DB01142 Doxepin Thumb 41.4%
6 Approved;
Investigational		 SmallMoleculeDrug DB01238 Aripiprazole Thumb 41.1%
7 Approved;
Vet approved		 SmallMoleculeDrug DB01221 Ketamine Thumb 41.0%
8 Approved SmallMoleculeDrug DB00408 Loxapine Thumb 40.0%
9 Approved;
Investigational		 SmallMoleculeDrug DB00568 Cinnarizine Thumb 39.4%
10 Approved SmallMoleculeDrug DB01224 Quetiapine Thumb 38.0%
11 Approved;
Illicit		 SmallMoleculeDrug DB00907 Cocaine Thumb 37.2%
12 Approved SmallMoleculeDrug DB09089 Trimebutine Thumb 36.7%
13 Approved;
Investigational		 SmallMoleculeDrug DB14185 Aripiprazole lauroxil Thumb 36.4%
14 Approved;
Withdrawn		 SmallMoleculeDrug DB01149 Nefazodone Thumb 35.6%
15 Approved SmallMoleculeDrug DB00540 Nortriptyline Thumb 35.4%
16 Approved;
Investigational		 SmallMoleculeDrug DB06148 Mianserin Thumb 35.0%
17 Approved SmallMoleculeDrug DB00246 Ziprasidone Thumb 34.6%
18 Approved SmallMoleculeDrug DB06153 Pizotifen Thumb 34.6%
19 Approved SmallMoleculeDrug DB09167 Dosulepin Thumb 34.1%
20 Approved SmallMoleculeDrug DB00370 Mirtazapine Thumb 34.1%


  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.