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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: P10275
No. Gene UniProt ID Protein Name Pathway PDB
1 AR P10275 Androgen receptor hsa04114; hsa05200; hsa05215


73 known interactions (drugs) of input target (AR): Androgen receptor
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image
1 Investigational SmallMoleculeDrug DB06133 Dimethylcurcumin Thumb
2 Approved;
Illicit		 SmallMoleculeDrug DB06412 Oxymetholone Thumb
3 Approved SmallMoleculeDrug DB01428 Oxybenzone Thumb
4 Approved SmallMoleculeDrug DB01128 Bicalutamide Thumb
5 Approved;
Illicit		 SmallMoleculeDrug DB01185 Fluoxymesterone Thumb
6 Approved;
Illicit		 SmallMoleculeDrug DB08804 Nandrolone decanoate Thumb
7 Experimental SmallMoleculeDrug DB08089 LGD-2226 Thumb
8 Investigational SmallMoleculeDrug DB13934 Ligandrol Thumb
9 Approved SmallMoleculeDrug DB01063 Acetophenazine Thumb
10 Approved;
Investigational		 SmallMoleculeDrug DB11901 Apalutamide Thumb
11 Experimental SmallMoleculeDrug DB08035 1-TERT-BUTYL-3-(2,5-DIMETHYLBENZYL)-1H-PYRAZOLO[3,4-D]PYRIMIDIN-4-AMINE Thumb
12 Approved;
Investigational		 SmallMoleculeDrug DB08604 Triclosan Thumb
13 Approved;
Investigational		 SmallMoleculeDrug DB04839 Cyproterone acetate Thumb
14 Approved;
Investigational		 SmallMoleculeDrug DB00957 Norgestimate Thumb
15 Approved;
Investigational		 SmallMoleculeDrug DB06713 Norelgestromin Thumb
16 Approved;
Illicit		 SmallMoleculeDrug DB00858 Drostanolone Thumb
17 Investigational SmallMoleculeDrug DB05234 LGD2941 Thumb
18 Experimental SmallMoleculeDrug DB07039 (2S)-N-(4-cyano-3-iodophenyl)-3-(4-cyanophenoxy)-2-hydroxy-2-methylpropanamide Thumb
19 Approved SmallMoleculeDrug DB13155 Esculin Thumb
20 Approved SmallMoleculeDrug DB00675 Tamoxifen Thumb
21 Approved SmallMoleculeDrug DB01406 Danazol Thumb
22 Approved SmallMoleculeDrug DB00655 Estrone Thumb
23 Experimental SmallMoleculeDrug DB02266 Flufenamic Acid Thumb
24 Approved SmallMoleculeDrug DB11619 Gestrinone Thumb
25 Approved;
Investigational		 SmallMoleculeDrug DB00499 Flutamide Thumb
26 Approved SmallMoleculeDrug DB09123 Dienogest Thumb
27 Approved;
Investigational		 SmallMoleculeDrug DB11064 Homosalate Thumb
28 Approved SmallMoleculeDrug DB09371 Norethynodrel Thumb
29 Experimental SmallMoleculeDrug DB02932 (R)-Bicalutamide Thumb
30 Approved SmallMoleculeDrug DB08899 Enzalutamide Thumb
31 Approved SmallMoleculeDrug DB01395 Drospirenone Thumb
32 Approved;
Investigational		 SmallMoleculeDrug DB00255 Diethylstilbestrol Thumb
33 Approved;
Investigational		 SmallMoleculeDrug DB00621 Oxandrolone Thumb
34 Approved;
Investigational		 SmallMoleculeDrug DB00687 Fludrocortisone Thumb
35 Approved SmallMoleculeDrug DB13943 Testosterone cypionate Thumb
36 Approved SmallMoleculeDrug DB00421 Spironolactone Thumb
37 Approved SmallMoleculeDrug DB13944 Testosterone enanthate Thumb
38 Experimental SmallMoleculeDrug DB07423 (2S)-3-[4-(acetylamino)phenoxy]-2-hydroxy-2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide Thumb
39 Experimental SmallMoleculeDrug DB07419 S-23 Thumb
40 Approved;
Vet approved		 SmallMoleculeDrug DB00396 Progesterone Thumb
41 Experimental;
Illicit;
Investigational		 SmallMoleculeDrug DB01481 1-Testosterone Thumb
42 Approved;
Illicit;
Investigational		 SmallMoleculeDrug DB00984 Nandrolone phenpropionate Thumb
43 Approved;
Investigational;
Nutraceutical		 SmallMoleculeDrug DB01708 Prasterone Thumb
44 Approved SmallMoleculeDrug DB08867 Ulipristal Thumb
45 Approved;
Investigational		 SmallMoleculeDrug DB01026 Ketoconazole Thumb
46 Experimental SmallMoleculeDrug DB08088 2-chloro-4-{[(1R,3Z,7S,7aS)-7-hydroxy-1-(trifluoromethyl)tetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-3-ylidene]amino}-3-methylbenzonitrile Thumb
47 Illicit;
Investigational		 SmallMoleculeDrug DB02901 Stanolone Thumb
48 Approved SmallMoleculeDrug DB06710 Methyltestosterone Thumb
49 Experimental;
Illicit		 SmallMoleculeDrug DB01564 Calusterone Thumb
50 Approved;
Investigational		 SmallMoleculeDrug DB00367 Levonorgestrel Thumb
51 Approved SmallMoleculeDrug DB09389 Norgestrel Thumb
52 Approved;
Investigational		 SmallMoleculeDrug DB00665 Nilutamide Thumb
53 Experimental SmallMoleculeDrug DB08461 3-[(4-AMINO-1-TERT-BUTYL-1H-PYRAZOLO[3,4-D]PYRIMIDIN-3-YL)METHYL]PHENOL Thumb
54 Approved;
Investigational;
Vet approved;
Withdrawn		 SmallMoleculeDrug DB01420 Testosterone propionate Thumb
55 Experimental SmallMoleculeDrug DB07286 BMS-564929 Thumb
56 Experimental SmallMoleculeDrug DB07717 (5S,8R,9S,10S,13R,14S,17S)-13-{2-[(3,5-DIFLUOROBENZYL)OXY]ETHYL}-17-HYDROXY-10-METHYLHEXADECAHYDRO-3H-CYCLOPENTA[A]PHENANTHREN-3-ONE Thumb
57 Approved SmallMoleculeDrug DB09086 Eugenol Thumb
58 Experimental SmallMoleculeDrug DB13951 Stanolone acetate Thumb
59 Approved SmallMoleculeDrug DB00623 Fluphenazine Thumb
60 Approved;
Investigational		 SmallMoleculeDrug DB01608 Propericiazine Thumb
61 Experimental SmallMoleculeDrug DB08087 4-[(7R,7AS)-7-HYDROXY-1,3-DIOXOTETRAHYDRO-1H-PYRROLO[1,2-C]IMIDAZOL-2(3H)-YL]-1-NAPHTHONITRILE Thumb
62 Illicit;
Vet approved		 SmallMoleculeDrug DB01541 Boldenone Thumb
63 Experimental SmallMoleculeDrug DB04709 (3AALPHA,4ALPHA,7ALPHA,7AALPHA)- 3A,4,7,7A-TETRAHYDRO-2-(4-NITRO-1-NAPHTHALENYL)-4,7-ETHANO-1H-ISOINDOLE-1,3(2H)-DIONE Thumb
64 Approved;
Investigational		 SmallMoleculeDrug DB00624 Testosterone Thumb
65 Experimental SmallMoleculeDrug DB07454 (R)-3-BROMO-2-HYDROXY-2-METHYL-N-[4-NITRO-3-(TRIFLUOROMETHYL)PHENYL]PROPANAMIDE Thumb
66 Experimental SmallMoleculeDrug DB02998 Methyltrienolone Thumb
67 Experimental SmallMoleculeDrug DB07421 4-{[(1R,2S)-1,2-dihydroxy-2-methyl-3-(4-nitrophenoxy)propyl]amino}-2-(trifluoromethyl)benzonitrile Thumb
68 Approved SmallMoleculeDrug DB00648 Mitotane Thumb
69 Experimental SmallMoleculeDrug DB07422 (2S)-2-hydroxy-2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]-3-(pentafluorophenoxy)propanamide Thumb
70 Approved SmallMoleculeDrug DB11219 Enzacamene Thumb
71 Approved;
Investigational		 SmallMoleculeDrug DB13946 Testosterone undecanoate Thumb
72 Experimental SmallMoleculeDrug DB06870 17-HYDROXY-18A-HOMO-19-NOR-17ALPHA-PREGNA-4,9,11-TRIEN-3-ONE Thumb
73 Experimental SmallMoleculeDrug DB07769 S-3-(4-FLUOROPHENOXY)-2-HYDROXY-2-METHYL-N-[4-NITRO-3-(TRIFLUOROMETHYL)PHENYL]PROPANAMIDE Thumb


20 predicted interactions (drugs) of input target (AR): Androgen receptor
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image Confidence score
1 Approved;
Withdrawn		 SmallMoleculeDrug DB00431 Lindane Thumb 55.3%
2 Approved SmallMoleculeDrug DB03147 Flavin adenine dinucleotide Thumb 54.9%
3 Approved;
Nutraceutical		 SmallMoleculeDrug DB00157 NADH Thumb 53.9%
4 Approved SmallMoleculeDrug DB01431 Allylestrenol Thumb 50.3%
5 Approved;
Investigational		 SmallMoleculeDrug DB09130 Copper Thumb 49.0%
6 Approved;
Investigational		 SmallMoleculeDrug DB00603 Medroxyprogesterone acetate Thumb 47.9%
7 Withdrawn SmallMoleculeDrug DB07931 Hexestrol Thumb 47.3%
8 Approved;
Withdrawn		 SmallMoleculeDrug DB04824 Phenolphthalein Thumb 47.2%
9 Approved;
Investigational		 SmallMoleculeDrug DB00834 Mifepristone Thumb 46.8%
10 Approved;
Investigational		 SmallMoleculeDrug DB11638 Artenimol Thumb 44.4%
11 Experimental SmallMoleculeDrug DB02746 Phthalic Acid Thumb 44.2%
12 Approved;
Investigational		 SmallMoleculeDrug DB00555 Lamotrigine Thumb 43.6%
13 Approved;
Experimental;
Investigational		 SmallMoleculeDrug DB02709 Resveratrol Thumb 42.4%
14 Approved SmallMoleculeDrug DB00588 Fluticasone propionate Thumb 42.4%
15 Approved;
Investigational		 SmallMoleculeDrug DB00393 Nimodipine Thumb 41.3%
16 Experimental SmallMoleculeDrug DB02615 Compound 19 Thumb 40.6%
17 Approved;
Investigational;
Withdrawn		 SmallMoleculeDrug DB00378 Dydrogesterone Thumb 40.6%
18 Approved SmallMoleculeDrug DB00823 Ethynodiol diacetate Thumb 40.2%
19 Experimental SmallMoleculeDrug DB08402 2-[(2,4-DICHLOROBENZOYL)AMINO]-5-(PYRIMIDIN-2-YLOXY)BENZOIC ACID Thumb 39.9%
20 Approved SmallMoleculeDrug DB00304 Desogestrel Thumb 39.7%


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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.