| Entry | |
|---|
| Name | Sumatriptan (JAN/USP/INN);
Imigran (TN);
Imitrex (TN) |
|---|
| Product | |
|---|
| Generic | |
|---|
| Formula | C14H21N3O2S
|
|---|
| Exact mass | 295.1354
|
|---|
| Mol weight | 295.40
|
|---|
| Structure | 
|
|---|
| Simcomp | |
|---|
| Class | |
|---|
| Remark | | Therapeutic category: | 2160 |
| Product (DG00836): | D00451<JP/US> D00676<JP/US> |
| Product (mixture): | D11577<US> |
|
|---|
| Efficacy | Antimigraine, Vasoconstrictor, Serotonin receptor agonist |
|---|
| Comment | Triptans
|
|---|
| Target | |
|---|
| Pathway | | hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Metabolism | |
|---|
| Interaction | |
|---|
| Structure map | | map07211 | Serotonin receptor agonists/antagonists |
|
|---|
| Brite | Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
N NERVOUS SYSTEM
N02 ANALGESICS
N02C ANTIMIGRAINE PREPARATIONS
N02CC Selective serotonin (5HT1) agonists
N02CC01 Sumatriptan
D00451 Sumatriptan (JAN/USP/INN) <JP/US>
USP drug classification [BR:br08302]
Antimigraine Agents
Serotonin (5-HT) Receptor Agonists
Sumatriptan
D00451 Sumatriptan (JAN/USP/INN)
Therapeutic category of drugs in Japan [BR:br08301]
2 Agents affecting individual organs
21 Cardiovascular agents
216 Vasoconstrictors
2160 Vasoconstrictors
D00451 Sumatriptan (JAN/USP/INN)
Drug groups [BR:br08330]
Analgesic
DG01484 5-HT1B-receptor agonist
DG00836 Sumatriptan
D00451 Sumatriptan
DG01485 5-HT1D-receptor agonist
DG00836 Sumatriptan
D00451 Sumatriptan
DG01518 5-HT1B/1D-receptor agonist
DG00836 Sumatriptan
D00451 Sumatriptan
DG01943 Triptan
DG00836 Sumatriptan
D00451 Sumatriptan
Metabolizing enzyme substrate
DG02917 MAO substrate
DG03178 MAOA substrate
DG00836 Sumatriptan
D00451 Sumatriptan
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Serotonin
HTR1B
D00451 Sumatriptan (JAN/USP/INN) <JP/US>
HTR1D
D00451 Sumatriptan (JAN/USP/INN) <JP/US>
Drug metabolizing enzymes and transporters [br08309.html]
Drug metabolizing enzymes
D00451
Drug groups [BR:br08330]
Analgesic
DG01484 5-HT1B-receptor agonist
DG00836 Sumatriptan
DG01485 5-HT1D-receptor agonist
DG00836 Sumatriptan
DG01518 5-HT1B/1D-receptor agonist
DG00836 Sumatriptan
DG01943 Triptan
DG00836 Sumatriptan
Metabolizing enzyme substrate
DG02917 MAO substrate
DG03178 MAOA substrate
DG00836 Sumatriptan
|
|---|
| Other DBs | |
|---|
| LinkDB | |
|---|
| KCF data |
ATOM 20
1 C8y C 27.5550 -17.9600
2 C8y C 27.5609 -19.3636
3 C8y C 28.8886 -17.5290
4 C8x C 26.3496 -17.2496
5 N4x N 28.8944 -19.7886
6 C8x C 26.3438 -20.0565
7 C8x C 29.7097 -18.6531
8 C1b C 29.2031 -16.1606
9 C8y C 25.1325 -17.9543
10 C8x C 25.1384 -19.3576
11 C1b C 30.5365 -15.7472
12 C1b C 23.9154 -17.2612
13 N1c N 30.8452 -14.3846
14 S4a S 22.7101 -17.9659
15 C1a C 32.1787 -13.9710
16 C1a C 29.8203 -13.4353
17 N1b N 21.5047 -17.2671
18 O3c O 23.7001 -18.9675
19 O3c O 21.7142 -18.9675
20 C1a C 20.2933 -17.9717
BOND 21
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 2 6 2
6 3 7 2
7 3 8 1
8 4 9 1
9 6 10 1
10 8 11 1
11 9 12 1
12 11 13 1
13 12 14 1
14 13 15 1
15 13 16 1
16 14 17 1
17 14 18 2
18 14 19 2
19 17 20 1
20 5 7 1
21 9 10 2
|
|---|
