| Entry |
|
|---|
| Name |
Almotriptan (USAN) |
|---|
| Formula |
C17H25N3O2S
|
|---|
| Exact mass |
335.1667
|
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| Mol weight |
335.47
|
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| Structure |
|
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| Simcomp |
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| Class |
|
|---|
| Remark |
| Product (DG00839): | D02825<US> |
|
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| Efficacy |
Antimigraine, Serotonin receptor agonist |
|---|
| Comment |
Sumatriptan derivative
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Metabolism |
|
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| Interaction |
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| Structure map |
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| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
N NERVOUS SYSTEM
N02 ANALGESICS
N02C ANTIMIGRAINE PREPARATIONS
N02CC Selective serotonin (5HT1) agonists
N02CC05 Almotriptan
D02824 Almotriptan (USAN)
Drug groups [BR:br08330]
Analgesic
DG01484 5-HT1B-receptor agonist
DG00839 Almotriptan
D02824 Almotriptan
DG01485 5-HT1D-receptor agonist
DG00839 Almotriptan
D02824 Almotriptan
DG01518 5-HT1B/1D-receptor agonist
DG00839 Almotriptan
D02824 Almotriptan
DG01943 Triptan
DG00839 Almotriptan
D02824 Almotriptan
Metabolizing enzyme substrate
DG01644 CYP2D6 substrate
DG00839 Almotriptan
D02824 Almotriptan
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
DG00839 Almotriptan
D02824 Almotriptan
DG02917 MAO substrate
DG03178 MAOA substrate
DG00839 Almotriptan
D02824 Almotriptan
Unclassified
DG03306 FMO substrate
DG02950 FMO3 substrate
DG00839 Almotriptan
D02824 Almotriptan
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Serotonin
HTR1B
D02824 Almotriptan (USAN)
HTR1D
D02824 Almotriptan (USAN)
Drug metabolizing enzymes and transporters [br08309.html]
Drug metabolizing enzymes
D02824
Drug groups [BR:br08330]
Analgesic
DG01484 5-HT1B-receptor agonist
DG00839 Almotriptan
DG01485 5-HT1D-receptor agonist
DG00839 Almotriptan
DG01518 5-HT1B/1D-receptor agonist
DG00839 Almotriptan
DG01943 Triptan
DG00839 Almotriptan
Metabolizing enzyme substrate
DG01644 CYP2D6 substrate
DG00839 Almotriptan
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
DG00839 Almotriptan
DG02917 MAO substrate
DG03178 MAOA substrate
DG00839 Almotriptan
Unclassified
DG03306 FMO substrate
DG02950 FMO3 substrate
DG00839 Almotriptan
|
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 23
1 C8y C 28.7441 -18.7760
2 C8y C 28.7441 -20.1826
3 C8y C 30.0803 -18.3540
4 C8x C 27.5484 -18.0726
5 N4x N 30.0803 -20.6046
6 C8x C 27.5484 -20.8859
7 C8x C 30.9243 -19.4792
8 C8y C 26.3528 -18.7760
9 C8x C 26.3528 -20.1826
10 C1b C 25.0869 -18.0726
11 S4a S 23.8912 -18.7760
12 O3c O 24.8759 -19.7606
13 O3c O 22.9066 -19.7606
14 N1y N 22.8980 -17.7801
15 C1x C 23.3329 -16.4424
16 C1x C 22.1950 -15.6153
17 C1x C 21.0569 -16.4419
18 C1x C 21.4913 -17.7797
19 C1b C 30.0803 -16.9521
20 C1b C 31.2827 -16.2579
21 N1c N 31.2827 -14.8400
22 C1a C 32.5006 -14.1368
23 C1a C 30.0757 -14.1432
BOND 25
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 4 8 1
8 6 9 1
9 8 10 1
10 10 11 1
11 11 12 2
12 11 13 2
13 5 7 1
14 8 9 2
15 11 14 1
16 14 15 1
17 15 16 1
18 16 17 1
19 17 18 1
20 14 18 1
21 3 19 1
22 19 20 1
23 20 21 1
24 21 22 1
25 21 23 1
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