| Entry |
|
|---|
| Name |
Sobetirome (USAN) |
|---|
| Formula |
C20H24O4
|
|---|
| Exact mass |
328.1675
|
|---|
| Mol weight |
328.4022
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Hormonal agent
DG01953 Thyroid preparation
|
|---|
| Remark |
|
|---|
| Efficacy |
Antidyslipidemia, Thyroid hormone receptor beta agonist |
|---|
| Comment |
Treatment of hypercholestemia obesity, and thyroid proliferative disorders
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Interaction |
|
|---|
| Brite |
Drug groups [BR:br08330]
Hormonal agent
DG01953 Thyroid preparation
D09381 Sobetirome
Target-based classification of drugs [BR:br08310]
Nuclear receptors
Thyroid hormone like receptors
Thyroid hormone receptor (THR)
NR1A2 (THRB)
D09381 Sobetirome (USAN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 24
1 O6a O 17.8500 -23.7300
2 C6a C 19.1100 -23.0300
3 C1b C 20.3000 -23.7300
4 O2a O 21.4900 -23.0300
5 C8y C 22.7500 -23.7300
6 O6a O 19.1100 -21.6300
7 C8x C 22.7500 -25.1300
8 C8y C 23.9400 -25.8300
9 C8y C 25.1300 -25.1300
10 C8y C 25.1300 -23.7300
11 C8x C 23.9400 -23.0300
12 C1a C 23.9400 -27.2300
13 C1b C 26.3900 -25.8300
14 C8y C 27.5800 -25.1300
15 C1a C 26.3200 -22.9600
16 C8x C 28.7700 -25.8300
17 C8y C 29.9600 -25.1300
18 C8y C 29.9600 -23.7300
19 C8x C 28.7700 -23.0300
20 C8x C 27.5800 -23.7300
21 O1a O 31.2200 -23.0300
22 C1c C 31.2200 -25.8300
23 C1a C 32.4100 -25.2000
24 C1a C 31.2200 -27.2300
BOND 25
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 2 6 2
6 5 7 2
7 7 8 1
8 8 9 2
9 9 10 1
10 10 11 2
11 5 11 1
12 8 12 1
13 9 13 1
14 13 14 1
15 10 15 1
16 14 16 2
17 16 17 1
18 17 18 2
19 18 19 1
20 19 20 2
21 14 20 1
22 18 21 1
23 17 22 1
24 22 23 1
25 22 24 1
|
|---|
