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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.


10 known interactions (drugs) of input target (AKT1): RAC-alpha serine/threonine-protein kinase
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter
Image
1 Experimental SmallMoleculeDrug DB07585 5-(5-chloro-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine Thumb
2 Investigational SmallMoleculeDrug DB01645 Genistein Thumb
3 Experimental SmallMoleculeDrug DB01863 Inositol 1,3,4,5-Tetrakisphosphate Thumb
4 Investigational SmallMoleculeDrug DB06641 Perifosine Thumb
5 Approved;
Experimental;
Investigational
SmallMoleculeDrug DB02709 Resveratrol Thumb
6 Investigational SmallMoleculeDrug DB05971 Archexin Thumb
7 Approved;
Investigational
SmallMoleculeDrug DB01169 Arsenic trioxide Thumb
8 Investigational SmallMoleculeDrug DB06486 Enzastaurin Thumb
9 Experimental SmallMoleculeDrug DB07584 N-[2-(5-methyl-4H-1,2,4-triazol-3-yl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine Thumb
10 Investigational;
Nutraceutical
SmallMoleculeDrug DB00171 ATP Thumb


20 predicted interactions (drugs) of input target (AKT1): RAC-alpha serine/threonine-protein kinase
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter
Image Confidence score
1 Approved;
Investigational;
Nutraceutical
SmallMoleculeDrug DB00131 Adenosine monophosphate Thumb 36.6%
2 Approved;
Investigational;
Nutraceutical
SmallMoleculeDrug DB00114 Pyridoxal Phosphate Thumb 32.2%
3 Approved SmallMoleculeDrug DB01016 Glyburide Thumb 32.1%
4 Experimental;
Investigational
SmallMoleculeDrug DB04216 Quercetin Thumb 31.0%
5 Approved;
Investigational
SmallMoleculeDrug DB01026 Ketoconazole Thumb 28.1%
6 Experimental SmallMoleculeDrug DB02494 Alpha-Hydroxy-Beta-Phenyl-Propionic Acid Thumb 27.5%
7 Experimental SmallMoleculeDrug DB03467 Naringenin Thumb 26.7%
8 Approved SmallMoleculeDrug DB00675 Tamoxifen Thumb 26.0%
9 Approved SmallMoleculeDrug DB00421 Spironolactone Thumb 25.9%
10 Approved;
Investigational
SmallMoleculeDrug DB08604 Triclosan Thumb 25.8%
11 Approved;
Investigational
SmallMoleculeDrug DB08862 Cholecystokinin Thumb 25.7%
12 Approved;
Investigational;
Nutraceutical
SmallMoleculeDrug DB00118 Ademetionine Thumb 23.9%
13 Approved;
Vet approved
SmallMoleculeDrug DB01159 Halothane Thumb 23.6%
14 Approved;
Withdrawn
SmallMoleculeDrug DB04824 Phenolphthalein Thumb 23.5%
15 Approved;
Vet approved
SmallMoleculeDrug DB00586 Diclofenac Thumb 23.4%
16 Experimental SmallMoleculeDrug DB07374 Anisomycin Thumb 23.2%
17 Experimental SmallMoleculeDrug DB07080 N-(2,2,2-TRIFLUOROETHYL)-N-{4-[2,2,2-TRIFLUORO-1-HYDROXY-1-(TRIFLUOROMETHYL)ETHYL]PHENYL}BENZENESULFONAMIDE Thumb 23.2%
18 Approved;
Vet approved
SmallMoleculeDrug DB00945 Acetylsalicylic acid Thumb 23.1%
19 Investigational SmallMoleculeDrug DB08398 2-Amino-1-methyl-6-phenylimidazo(4,5-b)pyridine Thumb 23.0%
20 Approved SmallMoleculeDrug DB00623 Fluphenazine Thumb 22.8%



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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.