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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: Q00653
No. Gene UniProt ID Protein Name Pathway PDB
1 NFKB2 Q00653 Nuclear factor NF-kappa-B p100 subunit hsa04010; hsa04064; hsa04380; hsa04625; hsa05134; hsa05166; hsa05169; hsa05200; hsa05203; hsa05224 1A3Q; 2D96; 3DO7; 4OT9


11 known interactions (drugs) of input target (NFKB2): Nuclear factor NF-kappa-B p100 subunit
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image
1 Investigational SmallMoleculeDrug DB05464 NOX-700 Thumb
2 Approved;
Vet approved		 SmallMoleculeDrug DB00945 Acetylsalicylic acid Thumb
3 Experimental;
Investigational		 SmallMoleculeDrug DB14059 SC-236 Thumb
4 Investigational SmallMoleculeDrug DB05451 P54 Thumb
5 Approved;
Experimental		 SmallMoleculeDrug DB13751 Glycyrrhizic acid Thumb
6 Approved;
Investigational		 SmallMoleculeDrug DB01296 Glucosamine Thumb
7 Investigational SmallMoleculeDrug DB05487 Custirsen Thumb
8 Investigational SmallMoleculeDrug DB05212 HE3286 Thumb
9 Approved;
Nutraceutical		 SmallMoleculeDrug DB13961 Fish oil Thumb
10 Investigational BiotechDrug DB05471 SGN-30 Thumb
11 Investigational SmallMoleculeDrug DB05767 Andrographolide Thumb


20 predicted interactions (drugs) of input target (NFKB2): Nuclear factor NF-kappa-B p100 subunit
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image Confidence score
1 Approved;
Investigational;
Withdrawn		 SmallMoleculeDrug DB01041 Thalidomide Thumb 48.1%
2 Approved;
Investigational		 SmallMoleculeDrug DB01411 Pranlukast Thumb 47.7%
3 Approved;
Investigational		 SmallMoleculeDrug DB08814 Triflusal Thumb 44.9%
4 Approved;
Investigational;
Nutraceutical		 SmallMoleculeDrug DB00143 Glutathione Thumb 32.1%
5 Approved SmallMoleculeDrug DB01050 Ibuprofen Thumb 27.2%
6 Approved;
Nutraceutical		 SmallMoleculeDrug DB00157 NADH Thumb 25.7%
7 Investigational SmallMoleculeDrug DB05869 Ethyl pyruvate Thumb 25.6%
8 Investigational SmallMoleculeDrug DB12695 Phenethyl Isothiocyanate Thumb 25.2%
9 Approved SmallMoleculeDrug DB00244 Mesalazine Thumb 23.9%
10 Approved;
Investigational		 SmallMoleculeDrug DB01118 Amiodarone Thumb 23.3%
11 Experimental SmallMoleculeDrug DB03541 10-Propargyl-5,8-Dideazafolic Acid Thumb 22.6%
12 Approved SmallMoleculeDrug DB06774 Capsaicin Thumb 22.3%
13 Experimental SmallMoleculeDrug DB04557 Arachidonic Acid Thumb 21.6%
14 Approved SmallMoleculeDrug DB00458 Imipramine Thumb 20.7%
15 Investigational BiotechDrug DB05758 CYT007-TNFQb Thumb 20.5%
16 Approved SmallMoleculeDrug DB08910 Pomalidomide Thumb 20.5%
17 Approved;
Investigational		 BiotechDrug DB01278 Pramlintide Thumb 19.9%
18 Investigational SmallMoleculeDrug DB05412 Talmapimod Thumb 18.8%
19 Approved;
Investigational		 SmallMoleculeDrug DB01017 Minocycline Thumb 18.7%
20 Investigational SmallMoleculeDrug DB06521 Ertiprotafib Thumb 18.7%


  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.