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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: P00813
No. Gene UniProt ID Protein Name Pathway PDB
1 ADA P00813 Adenosine deaminase hsa00230; hsa01100; hsa05340 1M7M; 3IAR


16 known interactions (drugs) of input target (ADA): Adenosine deaminase
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image
1 Approved SmallMoleculeDrug DB00975 Dipyridamole Thumb
2 Approved;
Investigational		 SmallMoleculeDrug DB00552 Pentostatin Thumb
3 Experimental SmallMoleculeDrug DB03572 FR230513 Thumb
4 Experimental SmallMoleculeDrug DB02830 FR236913 Thumb
5 Experimental SmallMoleculeDrug DB04218 1-Deaza-Adenosine Thumb
6 Experimental SmallMoleculeDrug DB02096 FR221647 Thumb
7 Experimental SmallMoleculeDrug DB07711 (2S,3R)-3-(6-amino-9H-purin-9-yl)nonan-2-ol Thumb
8 Experimental SmallMoleculeDrug DB07783 1-((1R)-1-(HYDROXYMETHYL)-3-{6-[(3-PHENYLPROPANOYL)AMINO]-1H-INDOL-1-YL}PROPYL)-1H-IMIDAZOLE-4-CARBOXAMIDE Thumb
9 Experimental SmallMoleculeDrug DB03370 FR239087 Thumb
10 Experimental SmallMoleculeDrug DB04440 Nebularine Thumb
11 Experimental SmallMoleculeDrug DB03220 FR233623 Thumb
12 Experimental SmallMoleculeDrug DB02472 6-Hydroxy-7,8-Dihydro Purine Nucleoside Thumb
13 Experimental SmallMoleculeDrug DB07786 1-((1R,2S)-1-{2-[2-(4-CHLOROPHENYL)-1,3-BENZOXAZOL-7-YL]ETHYL}-2-HYDROXYPROPYL)-1H-IMIDAZOLE-4-CARBOXAMIDE Thumb
14 Experimental SmallMoleculeDrug DB07785 1-{(1R,2S)-2-HYDROXY-1-[2-(2-NAPHTHYLOXY)ETHYL]PROPYL}-1H-IMIDAZONE-4-CARBOXAMIDE Thumb
15 Experimental SmallMoleculeDrug DB02616 FR117016 Thumb
16 Experimental SmallMoleculeDrug DB03015 6-Hydroxy-1,6-Dihydro Purine Nucleoside Thumb


20 predicted interactions (drugs) of input target (ADA): Adenosine deaminase
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image Confidence score
1 Approved;
Investigational		 SmallMoleculeDrug DB12010 Fostamatinib Thumb 30.2%
2 Nutraceutical SmallMoleculeDrug DB00116 Tetrahydrofolic acid Thumb 29.4%
3 Approved;
Investigational;
Nutraceutical		 SmallMoleculeDrug DB00131 Adenosine monophosphate Thumb 26.3%
4 Experimental SmallMoleculeDrug DB04447 1,4-Dithiothreitol Thumb 26.0%
5 Experimental;
Investigational		 SmallMoleculeDrug DB03366 Imidazole Thumb 25.6%
6 Approved;
Investigational		 SmallMoleculeDrug DB03247 Flavin mononucleotide Thumb 25.2%
7 Approved;
Investigational		 BiotechDrug DB00028 Immune Globulin Human Thumb 24.5%
8 Approved;
Withdrawn		 SmallMoleculeDrug DB04824 Phenolphthalein Thumb 24.2%
9 Approved;
Investigational		 SmallMoleculeDrug DB09289 Tianeptine Thumb 23.9%
10 Approved;
Vet approved		 SmallMoleculeDrug DB00586 Diclofenac Thumb 23.2%
11 Approved;
Nutraceutical		 SmallMoleculeDrug DB00157 NADH Thumb 23.2%
12 Experimental SmallMoleculeDrug DB04493 Fructose-6-Phosphate Thumb 22.7%
13 Investigational SmallMoleculeDrug DB04998 AGRO100 Thumb 22.7%
14 Approved;
Investigational;
Nutraceutical		 SmallMoleculeDrug DB00141 N-Acetylglucosamine Thumb 22.5%
15 Experimental SmallMoleculeDrug DB04016 2-[3-({Methyl[1-(2-Naphthoyl)Piperidin-4-Yl]Amino}Carbonyl)-2-Naphthyl]-1-(1-Naphthyl)-2-Oxoethylphosphonic Acid Thumb 22.3%
16 Experimental SmallMoleculeDrug DB04276 N-[N-[1-Hydroxycarboxyethyl-Carbonyl]Leucylamino-Butyl]-Guanidine Thumb 22.3%
17 Approved SmallMoleculeDrug DB09283 Trapidil Thumb 21.8%
18 Approved;
Investigational		 SmallMoleculeDrug DB05219 Crisaborole Thumb 21.5%
19 Experimental SmallMoleculeDrug DB02338 Nadph Dihydro-Nicotinamide-Adenine-Dinucleotidephosphate Thumb 21.1%
20 Experimental SmallMoleculeDrug DB08299 4-[8-(3-nitrophenyl)-1,7-naphthyridin-6-yl]benzoic acid Thumb 21.1%


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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.