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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: P02768
No. Gene UniProt ID Protein Name Pathway PDB
1 ALB P02768 Serum albumin hsa04918


12 known interactions (drugs) of input target (ALB): Serum albumin
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image
1 Approved SmallMoleculeDrug DB01045 Rifampicin Thumb
2 Approved;
Investigational		 SmallMoleculeDrug DB12965 Silver Thumb
3 Approved;
Investigational;
Vet approved		 SmallMoleculeDrug DB00199 Erythromycin Thumb
4 Approved;
Experimental		 SmallMoleculeDrug DB03255 Phenol Thumb
5 Approved;
Investigational		 SmallMoleculeDrug DB00276 Amsacrine Thumb
6 Experimental SmallMoleculeDrug DB06728 Aniline Thumb
7 Approved SmallMoleculeDrug DB13967 Patent Blue Thumb
8 Approved SmallMoleculeDrug DB00493 Cefotaxime Thumb
9 Approved;
Investigational		 SmallMoleculeDrug DB11638 Artenimol Thumb
10 Approved SmallMoleculeDrug DB11359 Guaiacol Thumb
11 Approved;
Investigational		 SmallMoleculeDrug DB00545 Pyridostigmine Thumb
12 Approved;
Investigational		 SmallMoleculeDrug DB06713 Norelgestromin Thumb


20 predicted interactions (drugs) of input target (ALB): Serum albumin
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image Confidence score
1 Approved;
Investigational;
Nutraceutical		 SmallMoleculeDrug DB00143 Glutathione Thumb 37.0%
2 Approved;
Investigational		 SmallMoleculeDrug DB01032 Probenecid Thumb 30.1%
3 Approved SmallMoleculeDrug DB00898 Ethanol Thumb 25.2%
4 Approved SmallMoleculeDrug DB00421 Spironolactone Thumb 24.9%
5 Approved;
Investigational		 SmallMoleculeDrug DB11642 Pitolisant Thumb 24.9%
6 Experimental SmallMoleculeDrug DB03721 N-acetyl-alpha-neuraminic acid Thumb 24.8%
7 Approved;
Investigational		 SmallMoleculeDrug DB01026 Ketoconazole Thumb 24.6%
8 Approved;
Vet approved		 SmallMoleculeDrug DB00396 Progesterone Thumb 23.9%
9 Approved;
Investigational		 SmallMoleculeDrug DB01593 Zinc Thumb 23.8%
10 Approved;
Nutraceutical		 SmallMoleculeDrug DB01373 Calcium Thumb 23.3%
11 Approved SmallMoleculeDrug DB01115 Nifedipine Thumb 22.7%
12 Investigational SmallMoleculeDrug DB05078 AER001 Thumb 22.5%
13 Investigational SmallMoleculeDrug DB12695 Phenethyl Isothiocyanate Thumb 22.4%
14 Approved;
Experimental		 SmallMoleculeDrug DB03017 Lauric Acid Thumb 22.3%
15 Approved;
Nutraceutical;
Vet approved		 SmallMoleculeDrug DB04272 Citric Acid Thumb 22.0%
16 Approved;
Investigational		 SmallMoleculeDrug DB01136 Carvedilol Thumb 21.8%
17 Experimental SmallMoleculeDrug DB03940 Oxamic Acid Thumb 21.8%
18 Approved;
Investigational		 SmallMoleculeDrug DB01074 Perhexiline Thumb 21.7%
19 Approved SmallMoleculeDrug DB00277 Theophylline Thumb 21.2%
20 Experimental SmallMoleculeDrug DB03276 4-[(10s,14s,18s)-18-(2-Amino-2-Oxoethyl)-14-(1-Naphthylmethyl)-8,17,20-Trioxo-7,16,19-Triazaspiro[5.14]Icos-11-En-10-Yl]Benzylphosphonic Acid Thumb 21.2%


  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.