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: O95342
No. Gene UniProt ID Protein Name Pathway PDB
1 ABCB11 O95342 Bile salt export pump hsa01522; hsa02010; hsa04976; hsa04979 NA


3 known interactions (drugs) of input target (ABCB11): Bile salt export pump
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image
1 Approved;
Investigational		 SmallMoleculeDrug DB00845 Clofazimine Thumb
2 Investigational;
Nutraceutical		 SmallMoleculeDrug DB00171 ATP Thumb
3 Approved SmallMoleculeDrug DB01016 Glyburide Thumb


20 predicted interactions (drugs) of input target (ABCB11): Bile salt export pump
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image Confidence score
1 Approved;
Investigational;
Nutraceutical		 SmallMoleculeDrug DB00131 Adenosine monophosphate Thumb 31.7%
2 Approved;
Investigational		 SmallMoleculeDrug DB01599 Probucol Thumb 23.1%
3 Approved;
Investigational		 SmallMoleculeDrug DB09220 Nicorandil Thumb 22.2%
4 Investigational SmallMoleculeDrug DB06486 Enzastaurin Thumb 20.2%
5 Approved;
Investigational		 SmallMoleculeDrug DB12010 Fostamatinib Thumb 18.6%
6 Approved;
Vet approved		 SmallMoleculeDrug DB01154 Thiamylal Thumb 16.7%
7 Investigational BiotechDrug DB06560 Pascolizumab Thumb 16.6%
8 Approved;
Investigational		 SmallMoleculeDrug DB00851 Dacarbazine Thumb 15.5%
9 Investigational SmallMoleculeDrug DB05004 AC162352 Thumb 14.5%
10 Approved SmallMoleculeDrug DB04871 Lorcaserin Thumb 14.4%
11 Investigational SmallMoleculeDrug DB05241 XL765 Thumb 14.3%
12 Approved;
Nutraceutical		 SmallMoleculeDrug DB00173 Adenine Thumb 14.2%
13 Approved;
Investigational;
Vet approved		 SmallMoleculeDrug DB01392 Yohimbine Thumb 13.8%
14 Approved;
Investigational		 SmallMoleculeDrug DB09462 Glycerin Thumb 13.6%
15 Approved;
Investigational		 SmallMoleculeDrug DB01227 Levomethadyl Acetate Thumb 13.6%
16 Approved;
Investigational		 SmallMoleculeDrug DB11712 Tezacaftor Thumb 13.4%
17 Approved;
Investigational		 SmallMoleculeDrug DB00555 Lamotrigine Thumb 13.0%
18 Approved;
Investigational;
Withdrawn		 SmallMoleculeDrug DB00914 Phenformin Thumb 12.8%
19 Experimental SmallMoleculeDrug DB03661 Cysteinesulfonic Acid Thumb 12.7%
20 Approved;
Investigational;
Nutraceutical		 SmallMoleculeDrug DB00174 L-Asparagine Thumb 12.6%


  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.