| Entry |
|
|---|
| Name |
Aripiprazole lauroxil (USAN);
Aristada (TN) |
|---|
| Product |
|
|---|
| Formula |
C36H51Cl2N3O4
|
|---|
| Exact mass |
659.3257
|
|---|
| Mol weight |
660.71
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Neuropsychiatric agent
DG03200 Antipsychotic agent
DG03064 Atypical antipsychotic
Metabolizing enzyme substrate
DG01644 CYP2D6 substrate
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
|
|---|
| Remark |
| Product (DG00906): | D01164<JP/US> D10364<US> D10516<JP/US> |
|
|---|
| Efficacy |
Antipsychotic, Dopamine receptor partial agonist, Serotonin receptor agonist/antagonist |
|---|
| Disease |
|
|---|
| Comment |
Phenylpiperazine derivative
Active form of prodrug: Aripiprazole [DR: D01164]
Treatment of schizophrenia, bipolar disorder, and clinical depression
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Metabolism |
Enzyme: CYP3A4 [HSA: 1576], CYP2D6 [HSA: 1565]
|
|---|
| Interaction |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
N NERVOUS SYSTEM
N05 PSYCHOLEPTICS
N05A ANTIPSYCHOTICS
N05AX Other antipsychotics
N05AX12 Aripiprazole
D10364 Aripiprazole lauroxil (USAN) <US>
USP drug classification [BR:br08302]
Antipsychotics
2nd Generation/Atypical
Aripiprazole
D10364 Aripiprazole lauroxil (USAN)
Drug groups [BR:br08330]
Neuropsychiatric agent
DG03200 Antipsychotic agent
DG03064 Atypical antipsychotic
DG00906 Aripiprazole
D10364 Aripiprazole lauroxil
Metabolizing enzyme substrate
DG01644 CYP2D6 substrate
DG00906 Aripiprazole
D10364 Aripiprazole lauroxil
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
DG00906 Aripiprazole
D10364 Aripiprazole lauroxil
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Dopamine
DRD2
D10364 Aripiprazole lauroxil (USAN) <US>
DRD3
D10364 Aripiprazole lauroxil (USAN) <US>
Serotonin
HTR1A
D10364 Aripiprazole lauroxil (USAN) <US>
HTR2A
D10364 Aripiprazole lauroxil (USAN) <US>
New drug approvals in the USA [br08319.html]
New molecular entities and new therapeutic biological products
D10364
New drug approvals in the USA, Europe and Japan [br08328.html]
Approval dates by FDA, EMA and PMDA
D10364
Drug metabolizing enzymes and transporters [br08309.html]
Drug metabolizing enzymes
D10364
Pharmacogenomic biomarkers [br08341.html]
Polymorphisms and mutations affecting drug response
D10364
Prodrugs [br08324.html]
D10364
Drug groups [BR:br08330]
Neuropsychiatric agent
DG03200 Antipsychotic agent
DG03064 Atypical antipsychotic
DG00906 Aripiprazole
Metabolizing enzyme substrate
DG01644 CYP2D6 substrate
DG00906 Aripiprazole
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
DG00906 Aripiprazole
|
|---|
| Other DBs |
|
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| LinkDB |
|
|---|
| KCF data |
ATOM 45
1 C8y C 14.3929 -15.6537
2 C8x C 14.3929 -14.2559
3 C8x C 13.2048 -13.5571
4 C8x C 13.2048 -16.3525
5 C8y C 11.9468 -15.6537
6 C8y C 11.9468 -14.2559
7 C1x C 9.5707 -14.1860
8 C5x C 9.5707 -15.5838
9 N1y N 10.7588 -16.3525
10 O5x O 8.3127 -16.2827
11 O2a O 15.5810 -16.3525
12 C1b C 16.8389 -15.6537
13 C1b C 18.0270 -16.3525
14 C1b C 19.2151 -15.6537
15 C1b C 20.4730 -16.3525
16 N1y N 21.7310 -15.6537
17 C1x C 22.8492 -16.3525
18 C1x C 24.1072 -15.6537
19 N1y N 24.1072 -14.2559
20 C1x C 22.8492 -13.5571
21 C1x C 21.7310 -14.2559
22 C8y C 25.2952 -13.5571
23 C8y C 26.4833 -14.2559
24 C8y C 27.7413 -13.5571
25 C8x C 27.7413 -12.1593
26 C8x C 26.4833 -11.4604
27 C8x C 25.2952 -12.1593
28 X Cl 26.4833 -15.6537
29 X Cl 28.9294 -14.2559
30 C1x C 10.7588 -13.5571
31 C1b C 10.7589 -17.7503
32 O7a O 11.9468 -18.4491
33 C7a C 11.9469 -19.9168
34 C1b C 13.1349 -20.6156
35 O6a O 10.6889 -20.5458
36 C1b C 14.3230 -19.9867
37 C1b C 15.5111 -20.6855
38 C1b C 16.6991 -19.9867
39 C1b C 17.9571 -20.7554
40 C1b C 19.1846 -20.0870
41 C1b C 20.3853 -20.8210
42 C1b C 21.6248 -20.1462
43 C1b C 22.7842 -20.8549
44 C1b C 24.0203 -20.1821
45 C1a C 25.2315 -20.9227
BOND 48
1 5 4 2
2 14 15 1
3 5 6 1
4 15 16 1
5 30 7 1
6 7 8 1
7 8 9 1
8 9 5 1
9 4 1 1
10 16 17 1
11 17 18 1
12 18 19 1
13 19 20 1
14 20 21 1
15 21 16 1
16 8 10 2
17 19 22 1
18 1 11 1
19 1 2 2
20 11 12 1
21 2 3 1
22 22 23 2
23 23 24 1
24 24 25 2
25 25 26 1
26 26 27 2
27 27 22 1
28 12 13 1
29 23 28 1
30 3 6 2
31 24 29 1
32 13 14 1
33 6 30 1
34 9 31 1
35 31 32 1
36 32 33 1
37 33 34 1
38 33 35 2
39 34 36 1
40 36 37 1
41 37 38 1
42 38 39 1
43 39 40 1
44 40 41 1
45 41 42 1
46 42 43 1
47 43 44 1
48 44 45 1
|
|---|
