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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: P11473
No. Gene UniProt ID Protein Name Pathway PDB
1 VDR P11473 Vitamin D3 receptor hsa04928; hsa04961; hsa04978; hsa05152


21 known interactions (drugs) of input target (VDR): Vitamin D3 receptor
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image
1 Approved;
Investigational		 SmallMoleculeDrug DB00910 Paricalcitol Thumb
2 Investigational SmallMoleculeDrug DB05295 Eldecalcitol Thumb
3 Approved;
Nutraceutical		 SmallMoleculeDrug DB01436 Alfacalcidol Thumb
4 Approved;
Investigational		 SmallMoleculeDrug DB04540 Cholesterol Thumb
5 Approved;
Nutraceutical		 SmallMoleculeDrug DB00146 Calcidiol Thumb
6 Experimental SmallMoleculeDrug DB08742 1,3-CYCLOHEXANEDIOL, 4-METHYLENE-5-[(2E)-[(1S,3AS,7AS)-OCTAHYDRO-1-(5-HYDROXY-5-METHYL-1,3-HEXADIYNYL)-7A-METHYL-4H-INDEN-4-YLIDENE]ETHYLIDENE]-, (1R,3S,5Z) Thumb
7 Experimental SmallMoleculeDrug DB07530 (1R,3R)-5-[(2E)-3-{(1S,3R)-2,2,3-trimethyl-3-[6,6,6-trifluoro-5-hydroxy-5-(trifluoromethyl)hex-3-yn-1-yl]cyclopentyl}prop-2-en-1-ylidene]cyclohexane-1,3-diol Thumb
8 Approved;
Nutraceutical		 SmallMoleculeDrug DB00153 Ergocalciferol Thumb
9 Investigational SmallMoleculeDrug DB04891 Becocalcidiol Thumb
10 Approved SmallMoleculeDrug DB01070 Dihydrotachysterol Thumb
11 Approved;
Nutraceutical		 SmallMoleculeDrug DB00169 Cholecalciferol Thumb
12 Experimental SmallMoleculeDrug DB03451 1-alpha, 25-dihydroxyl-20-epi-22-oxa-24, 26 ,27-trihomovitamin D3 Thumb
13 Experimental;
Investigational		 SmallMoleculeDrug DB04258 Seocalcitol Thumb
14 Experimental;
Investigational		 SmallMoleculeDrug DB04796 Inecalcitol Thumb
15 Investigational SmallMoleculeDrug DB05024 CTA018 Thumb
16 Investigational SmallMoleculeDrug DB06194 Elocalcitol Thumb
17 Approved;
Investigational		 SmallMoleculeDrug DB11672 Curcumin Thumb
18 Approved SmallMoleculeDrug DB02300 Calcipotriol Thumb
19 Approved;
Nutraceutical		 SmallMoleculeDrug DB00136 Calcitriol Thumb
20 Approved;
Nutraceutical;
Vet approved		 SmallMoleculeDrug DB11094 Vitamin D Thumb
21 Approved SmallMoleculeDrug DB06410 Doxercalciferol Thumb


20 predicted interactions (drugs) of input target (VDR): Vitamin D3 receptor
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image Confidence score
1 Investigational SmallMoleculeDrug DB12695 Phenethyl Isothiocyanate Thumb 29.0%
2 Experimental SmallMoleculeDrug DB03814 2-(N-Morpholino)-Ethanesulfonic Acid Thumb 28.8%
3 Investigational SmallMoleculeDrug DB05147 CYT997 Thumb 26.7%
4 Approved;
Nutraceutical		 SmallMoleculeDrug DB00159 Icosapent Thumb 25.4%
5 Experimental SmallMoleculeDrug DB06945 N-hydroxy-4-({4-[4-(trifluoromethyl)phenoxy]phenyl}sulfonyl)tetrahydro-2H-pyran-4-carboxamide Thumb 23.7%
6 Experimental SmallMoleculeDrug DB07863 2-chloro-5-nitro-N-phenylbenzamide Thumb 23.5%
7 Experimental SmallMoleculeDrug DB03880 Batimastat Thumb 23.4%
8 Approved;
Investigational		 SmallMoleculeDrug DB11638 Artenimol Thumb 23.4%
9 Approved;
Investigational		 SmallMoleculeDrug DB09130 Copper Thumb 22.6%
10 Experimental SmallMoleculeDrug DB02930 Adenosine 5'-[γ-thio]triphosphate Thumb 22.1%
11 Experimental;
Investigational		 SmallMoleculeDrug DB14059 SC-236 Thumb 21.9%
12 Approved BiotechDrug DB01307 Insulin Detemir Thumb 21.5%
13 Experimental;
Investigational		 SmallMoleculeDrug DB01873 Epothilone D Thumb 20.7%
14 Experimental SmallMoleculeDrug DB07930 (3R)-3-HYDROXYDODECANOIC ACID Thumb 20.4%
15 Approved;
Investigational		 BiotechDrug DB01277 Mecasermin Thumb 20.0%
16 Experimental SmallMoleculeDrug DB08537 3-bromo-6-phenyl-N-(pyrimidin-5-ylmethyl)imidazo[1,2-a]pyridin-8-amine Thumb 19.9%
17 Experimental SmallMoleculeDrug DB08388 5-(2-ETHOXYETHYL)-5-[4-(4-FLUOROPHENOXY)PHENOXY]PYRIMIDINE-2,4,6(1H,3H,5H)-TRIONE Thumb 19.8%
18 Experimental SmallMoleculeDrug DB03415 3-Thiaoctanoyl-Coenzyme A Thumb 19.8%
19 Experimental SmallMoleculeDrug DB07557 (5BETA)-PREGNANE-3,20-DIONE Thumb 19.5%
20 Approved;
Vet approved		 SmallMoleculeDrug DB08818 Hyaluronic acid Thumb 19.4%


  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.