| Entry |
|
|---|
| Name |
Vilazodone (USAN/INN) |
|---|
| Formula |
C26H27N5O2
|
|---|
| Exact mass |
441.2165
|
|---|
| Mol weight |
441.5249
|
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| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
|
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| Remark |
| Product (DG00964): | D09699<US> |
|
|---|
| Efficacy |
Antidepressant, Serotonin antagonist and reuptake inhibitor (SARI) |
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Metabolism |
Enzyme: CYP3A4 [HSA: 1576]; CYP2D6 [HSA: 1565], CYP2C19 [HSA: 1557]
|
|---|
| Interaction |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
N NERVOUS SYSTEM
N06 PSYCHOANALEPTICS
N06A ANTIDEPRESSANTS
N06AX Other antidepressants
N06AX24 Vilazodone
D09698 Vilazodone (USAN/INN)
Drug groups [BR:br08330]
Metabolizing enzyme substrate
DG01639 CYP2C19 substrate
DG00964 Vilazodone
D09698 Vilazodone
DG01644 CYP2D6 substrate
DG00964 Vilazodone
D09698 Vilazodone
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
DG00964 Vilazodone
D09698 Vilazodone
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Serotonin
HTR1A
D09698 Vilazodone (USAN/INN)
Transporters
Solute carrier family
SLC6
SLC6A4 (HTT)
D09698 Vilazodone (USAN/INN)
Drug metabolizing enzymes and transporters [br08309.html]
Drug metabolizing enzymes
D09698
Drug groups [BR:br08330]
Metabolizing enzyme substrate
DG01639 CYP2C19 substrate
DG00964 Vilazodone
DG01644 CYP2D6 substrate
DG00964 Vilazodone
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
DG00964 Vilazodone
|
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 33
1 C8x C 22.3300 -18.2700
2 C8y C 22.3300 -19.6700
3 C8x C 23.5200 -20.3700
4 C8y C 24.7800 -19.6700
5 C8y C 24.7800 -18.2700
6 C8x C 23.5200 -17.5700
7 C8x C 26.1100 -20.0900
8 C8y C 26.8800 -18.9700
9 O2x O 26.1100 -17.8500
10 N1y N 21.1400 -20.3700
11 C1x C 19.9500 -19.6700
12 C1x C 18.6900 -20.3700
13 N1y N 18.6900 -21.7700
14 C1x C 19.8800 -22.4700
15 C1x C 21.1400 -21.7700
16 C1b C 17.5000 -22.4700
17 C1b C 16.3100 -21.7700
18 C1b C 15.1200 -22.4700
19 C1b C 13.9300 -21.7700
20 C8y C 12.7400 -22.4700
21 C8x C 9.2400 -20.1600
22 C8x C 9.2400 -21.5600
23 C8y C 10.4300 -22.2600
24 C8y C 11.6900 -21.5600
25 C8x C 11.6900 -20.1600
26 C8y C 10.4300 -19.4600
27 N4x N 10.7100 -23.6600
28 C8x C 12.1100 -23.8000
29 C5a C 28.2800 -18.9700
30 N1a N 28.9800 -20.1824
31 O5a O 28.9800 -17.7576
32 C3b C 10.4300 -18.0600
33 N3a N 10.4300 -16.6600
BOND 37
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 4 7 1
8 7 8 2
9 8 9 1
10 5 9 1
11 2 10 1
12 10 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 14 15 1
17 10 15 1
18 13 16 1
19 16 17 1
20 17 18 1
21 18 19 1
22 19 20 1
23 21 22 2
24 22 23 1
25 23 24 2
26 24 25 1
27 25 26 2
28 21 26 1
29 23 27 1
30 27 28 1
31 28 20 2
32 24 20 1
33 8 29 1
34 29 30 1
35 29 31 2
36 26 32 1
37 32 33 3
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