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: P49585
No. Gene UniProt ID Protein Name Pathway PDB
1 PCYT1A P49585 Choline-phosphate cytidylyltransferase A hsa00440; hsa00564; hsa01100; hsa05231 NA


2 known interactions (drugs) of input target (PCYT1A): Choline-phosphate cytidylyltransferase A
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image
1 Approved;
Nutraceutical		 SmallMoleculeDrug DB00122 Choline Thumb
2 Approved;
Nutraceutical		 SmallMoleculeDrug DB14006 Choline salicylate Thumb


20 predicted interactions (drugs) of input target (PCYT1A): Choline-phosphate cytidylyltransferase A
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image Confidence score
1 Investigational SmallMoleculeDrug DB04892 Phenserine Thumb 22.9%
2 Approved SmallMoleculeDrug DB00674 Galantamine Thumb 20.7%
3 Investigational SmallMoleculeDrug DB05301 LAX-101 Thumb 19.3%
4 Approved SmallMoleculeDrug DB01199 Tubocurarine Thumb 18.8%
5 Approved SmallMoleculeDrug DB03128 Acetylcholine Thumb 16.7%
6 Approved;
Investigational		 SmallMoleculeDrug DB00989 Rivastigmine Thumb 16.6%
7 Approved SmallMoleculeDrug DB00201 Caffeine Thumb 15.4%
8 Experimental SmallMoleculeDrug DB03814 2-(N-Morpholino)-Ethanesulfonic Acid Thumb 14.9%
9 Approved;
Vet approved		 SmallMoleculeDrug DB00733 Pralidoxime Thumb 14.8%
10 Investigational SmallMoleculeDrug DB08846 Ellagic Acid Thumb 14.7%
11 Approved;
Investigational		 SmallMoleculeDrug DB00981 Physostigmine Thumb 14.2%
12 Approved;
Investigational		 SmallMoleculeDrug DB01273 Varenicline Thumb 14.0%
13 Experimental SmallMoleculeDrug DB07720 Epibatidine Thumb 13.8%
14 Approved;
Investigational		 SmallMoleculeDrug DB01088 Iloprost Thumb 13.6%
15 Approved SmallMoleculeDrug DB01010 Edrophonium Thumb 13.5%
16 Approved;
Investigational		 SmallMoleculeDrug DB09028 Cytisine Thumb 13.2%
17 Approved SmallMoleculeDrug DB00944 Demecarium Thumb 13.0%
18 Approved SmallMoleculeDrug DB09283 Trapidil Thumb 13.0%
19 Experimental SmallMoleculeDrug DB02811 Diethylphosphono Group Thumb 12.8%
20 Experimental SmallMoleculeDrug DB03672 9-N-Phenylmethylamino-Tacrine Thumb 12.7%


  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.