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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: Q9UM07
No. Gene UniProt ID Protein Name Pathway PDB
1 PADI4 Q9UM07 Protein-arginine deiminase type-4 NA 1WD8; 1WD9; 1WDA; 2DEW; 2DEX; 2DEY; 2DW5; 3APM; 3APN; 3B1T; 3B1U; 4DKT; 4X8C; 4X8G


6 known interactions (drugs) of input target (PADI4): Protein-arginine deiminase type-4
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image
1 Approved;
Investigational;
Vet approved		 SmallMoleculeDrug DB00254 Doxycycline Thumb
2 Approved;
Investigational;
Nutraceutical		 SmallMoleculeDrug DB00155 L-Citrulline Thumb
3 Approved SmallMoleculeDrug DB00207 Azithromycin Thumb
4 Approved;
Vet approved		 SmallMoleculeDrug DB00759 Tetracycline Thumb
5 Experimental SmallMoleculeDrug DB07449 N-[(1S)-1-(AMINOCARBONYL)-4-(ETHANIMIDOYLAMINO)BUTYL]BENZAMIDE Thumb
6 Approved;
Vet approved		 SmallMoleculeDrug DB01082 Streptomycin Thumb


20 predicted interactions (drugs) of input target (PADI4): Protein-arginine deiminase type-4
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image Confidence score
1 Approved;
Nutraceutical		 SmallMoleculeDrug DB00128 L-Aspartic Acid Thumb 24.8%
2 Approved;
Investigational;
Vet approved		 SmallMoleculeDrug DB01234 Dexamethasone Thumb 22.3%
3 Approved;
Investigational;
Nutraceutical		 SmallMoleculeDrug DB00166 Lipoic Acid Thumb 22.1%
4 Experimental SmallMoleculeDrug DB04530 S,S-(2-Hydroxyethyl)Thiocysteine Thumb 21.2%
5 Experimental SmallMoleculeDrug DB02740 3-Indolebutyric Acid Thumb 19.5%
6 Investigational;
Nutraceutical		 SmallMoleculeDrug DB00171 ATP Thumb 19.5%
7 Approved;
Investigational		 SmallMoleculeDrug DB12965 Silver Thumb 17.5%
8 Experimental SmallMoleculeDrug DB02878 3-(2-Aminoethyl)-4-(Aminomethyl)Heptanedioic Acid Thumb 17.2%
9 Approved;
Experimental		 SmallMoleculeDrug DB03796 Palmitic Acid Thumb 17.1%
10 Approved;
Investigational		 BiotechDrug DB11300 Thrombin Thumb 16.9%
11 Experimental;
Investigational		 SmallMoleculeDrug DB04216 Quercetin Thumb 16.8%
12 Experimental SmallMoleculeDrug DB07642 5-{[1-(2-fluorobenzyl)piperidin-4-yl]methoxy}quinazoline-2,4-diamine Thumb 16.7%
13 Approved;
Investigational		 SmallMoleculeDrug DB01074 Perhexiline Thumb 16.6%
14 Investigational SmallMoleculeDrug DB05434 ABT-510 Thumb 16.5%
15 Approved;
Withdrawn		 SmallMoleculeDrug DB00761 Potassium Chloride Thumb 16.4%
16 Approved SmallMoleculeDrug DB00836 Loperamide Thumb 15.8%
17 Investigational SmallMoleculeDrug DB05967 ANZ-100 Thumb 15.3%
18 Approved;
Investigational		 SmallMoleculeDrug DB01296 Glucosamine Thumb 15.0%
19 Experimental SmallMoleculeDrug DB08597 6-[4-(2-piperidin-1-ylethoxy)phenyl]-3-pyridin-4-ylpyrazolo[1,5-a]pyrimidine Thumb 14.6%
20 Experimental SmallMoleculeDrug DB01972 Guanosine-5'-Monophosphate Thumb 14.5%


  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.