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: Q9NPC1
No. Gene UniProt ID Protein Name Pathway PDB
1 LTB4R2 Q9NPC1 Leukotriene B4 receptor 2 hsa04020; hsa04080 NA


2 known interactions (drugs) of input target (LTB4R2): Leukotriene B4 receptor 2
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image
1 Investigational SmallMoleculeDrug DB06248 Amelubant Thumb
2 Investigational SmallMoleculeDrug DB12961 Leukotriene B4 Thumb


20 predicted interactions (drugs) of input target (LTB4R2): Leukotriene B4 receptor 2
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image Confidence score
1 Approved SmallMoleculeDrug DB09285 Morniflumate Thumb 26.8%
2 Approved;
Nutraceutical		 SmallMoleculeDrug DB00139 Succinic acid Thumb 20.6%
3 Experimental SmallMoleculeDrug DB02078 Triglyme Thumb 18.6%
4 Approved;
Investigational		 SmallMoleculeDrug DB12965 Silver Thumb 16.3%
5 Approved;
Experimental;
Investigational		 SmallMoleculeDrug DB02709 Resveratrol Thumb 15.3%
6 Approved BiotechDrug DB00071 Insulin Pork Thumb 15.1%
7 Experimental SmallMoleculeDrug DB03740 N-acetyl-alpha-D-glucosamine Thumb 14.8%
8 Experimental SmallMoleculeDrug DB04557 Arachidonic Acid Thumb 14.7%
9 Investigational SmallMoleculeDrug DB05147 CYT997 Thumb 14.1%
10 Approved;
Investigational		 BiotechDrug DB00030 Insulin Human Thumb 14.1%
11 Approved;
Investigational		 SmallMoleculeDrug DB00486 Nabilone Thumb 14.0%
12 Approved;
Investigational		 SmallMoleculeDrug DB01593 Zinc Thumb 13.6%
13 Approved;
Experimental		 SmallMoleculeDrug DB03193 Stearic acid Thumb 13.4%
14 Investigational SmallMoleculeDrug DB12695 Phenethyl Isothiocyanate Thumb 13.3%
15 Approved;
Investigational		 SmallMoleculeDrug DB01282 Carbetocin Thumb 13.2%
16 Investigational SmallMoleculeDrug DB04971 Reglixane Thumb 12.3%
17 Approved;
Investigational		 SmallMoleculeDrug DB01026 Ketoconazole Thumb 12.2%
18 Experimental SmallMoleculeDrug DB02930 Adenosine 5'-[γ-thio]triphosphate Thumb 12.2%
19 Investigational BiotechDrug DB05915 MYO-029 Thumb 12.1%
20 Approved;
Investigational		 BiotechDrug DB13933 Nonacog beta pegol Thumb 12.1%


  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.