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: P41252
No. Gene UniProt ID Protein Name Pathway PDB
1 IARS P41252 Isoleucine--tRNA ligase, cytoplasmic hsa00970 NA


1 known interactions (drugs) of input target (IARS): Isoleucine--tRNA ligase, cytoplasmic
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image
1 Approved;
Investigational;
Nutraceutical		 SmallMoleculeDrug DB00167 L-Isoleucine Thumb


18 predicted interactions (drugs) of input target (IARS): Isoleucine--tRNA ligase, cytoplasmic
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image Confidence score
1 Approved;
Nutraceutical		 SmallMoleculeDrug DB00142 Glutamic Acid Thumb 32.9%
2 Approved SmallMoleculeDrug DB01016 Glyburide Thumb 18.9%
3 Approved;
Investigational		 SmallMoleculeDrug DB09130 Copper Thumb 17.3%
4 Approved;
Nutraceutical		 SmallMoleculeDrug DB00149 L-Leucine Thumb 17.3%
5 Approved SmallMoleculeDrug DB00898 Ethanol Thumb 16.4%
6 Experimental SmallMoleculeDrug DB02635 N-[O-Phosphono-Pyridoxyl]-Isoleucine Thumb 15.0%
7 Approved;
Investigational		 SmallMoleculeDrug DB03088 Pidolic Acid Thumb 13.9%
8 Experimental SmallMoleculeDrug DB02142 Pyridoxamine-5'-Phosphate Thumb 13.6%
9 Approved;
Investigational		 SmallMoleculeDrug DB08862 Cholecystokinin Thumb 13.4%
10 Experimental SmallMoleculeDrug DB04074 Alpha-ketoisovalerate Thumb 12.5%
11 Approved;
Experimental		 SmallMoleculeDrug DB03796 Palmitic Acid Thumb 12.1%
12 Approved;
Investigational;
Withdrawn		 BiotechDrug DB06692 Aprotinin Thumb 11.7%
13 Approved SmallMoleculeDrug DB08896 Regorafenib Thumb 11.7%
14 Experimental SmallMoleculeDrug DB06987 2-(4-(2-HYDROXY-3-(ISOPROPYLAMINO)PROPOXY)PHENYL)ETHANAMIDE Thumb 11.2%
15 Experimental SmallMoleculeDrug DB04400 L-erythro-7,8-dihydrobiopterin Thumb 10.7%
16 Approved;
Investigational		 BiotechDrug DB09052 Blinatumomab Thumb 10.1%
17 Experimental SmallMoleculeDrug DB07544 N'-(5-CHLOROBENZOFURAN-2-CARBONYL)-2-(TRIFLUOROMETHYL)BENZENESULFONOHYDRAZIDE Thumb 10.1%
18 Investigational SmallMoleculeDrug DB05483 PCL-016 Thumb 10.1%


  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.