| Entry |
|
|---|
| Name |
Nemonapride (JAN/INN);
Emilace (TN) |
|---|
| Formula |
C21H26ClN3O2
|
|---|
| Exact mass |
387.1714
|
|---|
| Mol weight |
387.903
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Neuropsychiatric agent
DG01478 Dopamine antagonist
DG01474 Dopamine D2-receptor antagonist
DG03200 Antipsychotic agent
DG01941 Benzamide antipsychotic
Metabolizing enzyme substrate
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
|
|---|
| Remark |
| Therapeutic category: | 1179 |
|
|---|
| Efficacy |
Antipsychotic, Dopamine receptor antagonist |
|---|
| Comment |
Benzamide derivative
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Metabolism |
Enzyme: CYP3A4 [HSA: 1576]
|
|---|
| Interaction |
|
|---|
| Structure map |
| map07213 | Dopamine receptor agonists/antagonists |
|
|---|
| Brite |
Therapeutic category of drugs in Japan [BR:br08301]
1 Agents affecting nervous system and sensory organs
11 Agents affecting central nervous system
117 Psychotropics
1179 Others
D01468 Nemonapride (JAN/INN)
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01478 Dopamine antagonist
DG01474 Dopamine D2-receptor antagonist
D01468 Nemonapride
DG03200 Antipsychotic agent
DG01941 Benzamide antipsychotic
D01468 Nemonapride
Metabolizing enzyme substrate
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
D01468 Nemonapride
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Dopamine
DRD2
D01468 Nemonapride (JAN/INN) <JP>
Drug metabolizing enzymes and transporters [br08309.html]
Drug metabolizing enzymes
D01468
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 27
1 C1y C 32.7589 -18.1959
2 C1x C 33.1864 -19.5720
3 C1x C 34.5731 -19.5913
4 N1y N 35.0196 -18.2783
5 C1y C 33.9091 -17.4477
6 C8y C 29.1082 -17.5095
7 C8y C 29.1082 -16.1033
8 C8x C 27.9062 -18.2037
9 C5a C 30.3276 -18.2037
10 C8x C 27.9062 -15.3974
11 O2a O 30.3276 -15.3974
12 C8y C 26.6868 -17.5095
13 N1b N 31.5410 -17.5035
14 O5a O 30.3276 -19.6097
15 C8y C 26.6868 -16.1033
16 X Cl 25.4734 -18.2037
17 N1b N 25.4734 -15.3974
18 C1a C 24.2622 -16.0914
19 C1b C 36.1985 -17.6066
20 C8y C 37.4141 -18.2932
21 C8x C 37.3542 -19.6860
22 C8x C 38.6394 -20.3726
23 C8x C 39.8417 -19.6632
24 C8x C 39.8284 -18.2674
25 C8x C 38.6131 -17.5808
26 C1a C 30.3290 -13.9734
27 C1a C 33.9558 -16.0321
BOND 29
1 8 12 1
2 9 13 1
3 9 14 2
4 10 15 1
5 12 16 1
6 1 13 1 #Up
7 15 17 1
8 12 15 2
9 6 7 1
10 6 8 2
11 17 18 1
12 6 9 1
13 2 3 1
14 4 19 1
15 3 4 1
16 19 20 1
17 4 5 1
18 5 1 1
19 1 2 1
20 7 10 2
21 20 21 2
22 21 22 1
23 22 23 2
24 23 24 1
25 24 25 2
26 25 20 1
27 7 11 1
28 11 26 1
29 5 27 1 #Up
|
|---|
