| Entry |
|
|---|
| Name |
Pimozide (JP18/USP/INN);
Orap (TN) |
|---|
| Product |
|
|---|
| Generic |
|
|---|
| Formula |
C28H29F2N3O
|
|---|
| Exact mass |
461.2279
|
|---|
| Mol weight |
461.54
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Metabolizing enzyme substrate
DG01644 CYP2D6 substrate
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
|
|---|
| Remark |
|
|---|
| Efficacy |
Antipsychotic, Dopamine receptor antagonist |
|---|
| Disease |
Tourette’s disorder [DS: H00862] |
|---|
| Comment |
Diphenylbutylpiperidine derivative
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Metabolism |
Enzyme: CYP3A4 [HSA: 1576]; CYP2D6 [HSA: 1565]
|
|---|
| Interaction |
|
|---|
| Structure map |
| map07031 | Antipsychotics - butyrophenones |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
N NERVOUS SYSTEM
N05 PSYCHOLEPTICS
N05A ANTIPSYCHOTICS
N05AG Diphenylbutylpiperidine derivatives
N05AG02 Pimozide
D00560 Pimozide (JP18/USP/INN) <US>
USP drug classification [BR:br08302]
Antipsychotics
1st Generation/Typical
Pimozide
D00560 Pimozide (JP18/USP/INN)
Drug groups [BR:br08330]
Metabolizing enzyme substrate
DG01644 CYP2D6 substrate
D00560 Pimozide
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
D00560 Pimozide
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Adrenaline
ADRA2A
D00560 Pimozide (JP18/USP/INN) <US>
Dopamine
DRD2
D00560 Pimozide (JP18/USP/INN) <US>
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
Chemicals
D00560 Pimozide
Drug metabolizing enzymes and transporters [br08309.html]
Drug metabolizing enzymes
D00560
Pharmacogenomic biomarkers [br08341.html]
Polymorphisms and mutations affecting drug response
D00560
|
|---|
| Other DBs |
|
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| LinkDB |
|
|---|
| KCF data |
ATOM 34
1 C8x C 3.3600 -23.5200
2 C8y C 3.3600 -24.9200
3 C8x C 4.5724 -25.6200
4 C8x C 5.7849 -24.9200
5 C8y C 5.7849 -23.5200
6 C8x C 4.5724 -22.8200
7 C8x C 8.2097 -24.9200
8 C8y C 8.2097 -23.5200
9 C1c C 6.9973 -22.8200
10 C8x C 9.4222 -25.6200
11 C8y C 10.6346 -24.9200
12 C8x C 10.6346 -23.5200
13 C8x C 9.4222 -22.8200
14 X F 2.1476 -25.6200
15 X F 11.8511 -25.6223
16 C1b C 6.9973 -21.4200
17 C1b C 8.2118 -20.7188
18 C1b C 9.4083 -21.4098
19 N1y N 10.5951 -20.7246
20 C1x C 11.7866 -21.4128
21 C1x C 12.9991 -20.7129
22 C1y C 12.9993 -19.3129
23 C1x C 11.8078 -18.6248
24 C1x C 10.5953 -19.3246
25 N4y N 14.2241 -18.6058
26 C8y C 14.2241 -17.2058
27 O5x O 13.0074 -16.5032
28 C8y C 15.5556 -19.0384
29 C8y C 16.3785 -17.9058
30 N4x N 15.5556 -16.7732
31 C8x C 17.7785 -17.9058
32 C8x C 18.4851 -19.1295
33 C8x C 17.7922 -20.3294
34 C8x C 16.3803 -20.3296
BOND 38
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 7 8 1
8 8 9 1
9 5 9 1
10 7 10 2
11 10 11 1
12 11 12 2
13 12 13 1
14 8 13 2
15 2 14 1
16 11 15 1
17 9 16 1
18 16 17 1
19 17 18 1
20 18 19 1
21 19 20 1
22 20 21 1
23 21 22 1
24 22 23 1
25 23 24 1
26 19 24 1
27 22 25 1
28 25 26 1
29 26 27 2
30 25 28 1
31 28 29 2
32 29 30 1
33 26 30 1
34 29 31 1
35 31 32 2
36 32 33 1
37 33 34 2
38 34 28 1
|
|---|
