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: O75521
No. Gene UniProt ID Protein Name Pathway PDB
1 ECI2 O75521 Enoyl-CoA delta isomerase 2, mitochondrial hsa00071; hsa04146 2CQU; 2F6Q; 4U18; 4U19; 4U1A


1 known interactions (drugs) of input target (ECI2): Enoyl-CoA delta isomerase 2, mitochondrial
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image
1 Experimental SmallMoleculeDrug DB08231 Myristic acid Thumb


20 predicted interactions (drugs) of input target (ECI2): Enoyl-CoA delta isomerase 2, mitochondrial
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image Confidence score
1 Approved;
Experimental		 SmallMoleculeDrug DB03017 Lauric Acid Thumb 23.1%
2 Investigational SmallMoleculeDrug DB11693 Voclosporin Thumb 15.8%
3 Approved;
Nutraceutical;
Vet approved		 SmallMoleculeDrug DB01065 Melatonin Thumb 15.8%
4 Experimental SmallMoleculeDrug DB02767 3-Hydroxy-Myristic Acid Thumb 15.5%
5 Experimental SmallMoleculeDrug DB03760 Dihydrolipoic Acid Thumb 14.7%
6 Experimental SmallMoleculeDrug DB03758 Radicicol Thumb 14.3%
7 Approved;
Nutraceutical;
Vet approved		 SmallMoleculeDrug DB00145 Glycine Thumb 14.1%
8 Approved;
Investigational		 SmallMoleculeDrug DB00481 Raloxifene Thumb 13.7%
9 Approved SmallMoleculeDrug DB02659 Cholic Acid Thumb 13.4%
10 Experimental SmallMoleculeDrug DB03203 Sphingosine Thumb 13.2%
11 Experimental SmallMoleculeDrug DB07119 1-CHLORO-6-(4-HYDROXYPHENYL)-2-NAPHTHOL Thumb 12.6%
12 Investigational;
Withdrawn		 SmallMoleculeDrug DB00197 Troglitazone Thumb 11.9%
13 Experimental SmallMoleculeDrug DB01776 M-Cresol Thumb 11.8%
14 Approved;
Experimental		 SmallMoleculeDrug DB13615 Mifamurtide Thumb 11.5%
15 Withdrawn SmallMoleculeDrug DB04821 Nomifensine Thumb 11.4%
16 Approved;
Experimental;
Investigational		 SmallMoleculeDrug DB02709 Resveratrol Thumb 11.3%
17 Approved;
Investigational		 SmallMoleculeDrug DB00583 L-Carnitine Thumb 11.2%
18 Approved SmallMoleculeDrug DB00535 Cefdinir Thumb 11.0%
19 Investigational SmallMoleculeDrug DB05457 OSI-7904L Thumb 10.9%
20 Experimental SmallMoleculeDrug DB07557 (5BETA)-PREGNANE-3,20-DIONE Thumb 10.5%


  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.