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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: P08100
No. Gene UniProt ID Protein Name Pathway PDB
1 RHO P08100 Rhodopsin hsa04744 4ZWJ


13 known interactions (drugs) of input target (RHO): Rhodopsin
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image
1 Experimental SmallMoleculeDrug DB02482 Phosphonothreonine Thumb
2 Experimental SmallMoleculeDrug DB04233 (Hydroxyethyloxy)Tri(Ethyloxy)Octane Thumb
3 Experimental SmallMoleculeDrug DB01728 3-[Aminoethylphosphoryl]-[1,2-Di-Palmitoyl]-Sn-Glycerol Thumb
4 Experimental SmallMoleculeDrug DB03152 B-2-Octylglucoside Thumb
5 Experimental SmallMoleculeDrug DB04522 Dexfosfoserine Thumb
6 Experimental SmallMoleculeDrug DB01646 N-Acetylmethionine Thumb
7 Experimental SmallMoleculeDrug DB04450 Heptyl 1-Thiohexopyranoside Thumb
8 Experimental SmallMoleculeDrug DB02451 B-nonylglucoside Thumb
9 Approved;
Vet approved		 SmallMoleculeDrug DB01159 Halothane Thumb
10 Experimental SmallMoleculeDrug DB04147 Lauryl Dimethylamine-N-Oxide Thumb
11 Experimental SmallMoleculeDrug DB03381 Hexadecanal Thumb
12 Approved;
Experimental		 SmallMoleculeDrug DB03796 Palmitic Acid Thumb
13 Experimental SmallMoleculeDrug DB04079 Heptane-1,2,3-Triol Thumb


20 predicted interactions (drugs) of input target (RHO): Rhodopsin
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image Confidence score
1 Approved SmallMoleculeDrug DB00675 Tamoxifen Thumb 28.5%
2 Approved;
Investigational		 SmallMoleculeDrug DB09462 Glycerin Thumb 27.7%
3 Approved;
Investigational		 SmallMoleculeDrug DB00659 Acamprosate Thumb 27.7%
4 Experimental SmallMoleculeDrug DB01863 Inositol 1,3,4,5-Tetrakisphosphate Thumb 27.2%
5 Experimental SmallMoleculeDrug DB08222 METHOXYUNDECYLPHOSPHINIC ACID Thumb 26.5%
6 Approved;
Investigational		 SmallMoleculeDrug DB00622 Nicardipine Thumb 24.8%
7 Approved;
Investigational		 SmallMoleculeDrug DB12010 Fostamatinib Thumb 24.1%
8 Experimental SmallMoleculeDrug DB02035 1-Hexadecylsulfonyl Fluoride Thumb 24.1%
9 Approved SmallMoleculeDrug DB00648 Mitotane Thumb 23.6%
10 Approved;
Vet approved		 SmallMoleculeDrug DB00561 Doxapram Thumb 23.2%
11 Approved SmallMoleculeDrug DB00491 Miglitol Thumb 23.1%
12 Experimental SmallMoleculeDrug DB04530 S,S-(2-Hydroxyethyl)Thiocysteine Thumb 22.2%
13 Approved SmallMoleculeDrug DB09089 Trimebutine Thumb 22.2%
14 Approved;
Investigational		 BiotechDrug DB11300 Thrombin Thumb 22.1%
15 Approved SmallMoleculeDrug DB13872 Lormetazepam Thumb 21.9%
16 Approved SmallMoleculeDrug DB00898 Ethanol Thumb 21.7%
17 Approved;
Nutraceutical		 SmallMoleculeDrug DB00169 Cholecalciferol Thumb 20.9%
18 Investigational SmallMoleculeDrug DB05428 motexafin gadolinium Thumb 20.8%
19 Approved;
Illicit;
Investigational		 SmallMoleculeDrug DB01558 Bromazepam Thumb 20.8%
20 Experimental SmallMoleculeDrug DB03316 1,4-Diethylene Dioxide Thumb 20.6%


  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.