| Entry |
|
|---|
| Name |
Procaterol hydrochloride hydrate (JP18);
Meptin (TN) |
|---|
| Formula |
(C16H22N2O3)2. 2HCl. H2O
|
|---|
| Exact mass |
670.29
|
|---|
| Mol weight |
671.6521
|
|---|
| Structure |
|
|---|
| Class |
Cardiovascular agent
DG01456 Adrenergic receptor agonist
DG01455 beta-Adrenergic receptor agonist
DG01452 beta2-Adrenergic receptor agonist
Metabolizing enzyme substrate
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
|
|---|
| Remark |
| Therapeutic category: | 2259 |
| Product (DG01055): | D05366<JP> |
|
|---|
| Efficacy |
Bronchodilator, beta2-Adrenergic receptor agonist |
|---|
| Comment |
Phenethylamine derivative
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Metabolism |
Enzyme: CYP3A4 [HSA: 1576]
|
|---|
| Interaction |
|
|---|
| Structure map |
| map07214 | beta-Adrenergic receptor agonists/antagonists |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
R RESPIRATORY SYSTEM
R03 DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
R03A ADRENERGICS, INHALANTS
R03AC Selective beta-2-adrenoreceptor agonists
R03AC16 Procaterol
D05366 Procaterol hydrochloride hydrate (JP18) <JP>
R03C ADRENERGICS FOR SYSTEMIC USE
R03CC Selective beta-2-adrenoreceptor agonists
R03CC08 Procaterol
D05366 Procaterol hydrochloride hydrate (JP18) <JP>
Therapeutic category of drugs in Japan [BR:br08301]
2 Agents affecting individual organs
22 Respiratory organ agents
225 Bronchodilators
2259 Others
D05366 Procaterol hydrochloride hydrate (JP18)
Drug groups [BR:br08330]
Cardiovascular agent
DG01456 Adrenergic receptor agonist
DG01455 beta-Adrenergic receptor agonist
DG01452 beta2-Adrenergic receptor agonist
DG01055 Procaterol
D05366 Procaterol hydrochloride hydrate
Metabolizing enzyme substrate
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
DG01055 Procaterol
D05366 Procaterol hydrochloride hydrate
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Adrenaline
ADRB2
D05366 Procaterol hydrochloride hydrate (JP18) <JP>
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
Chemicals
D05366 Procaterol hydrochloride hydrate
Drug metabolizing enzymes and transporters [br08309.html]
Drug metabolizing enzymes
D05366
Drug groups [BR:br08330]
Cardiovascular agent
DG01456 Adrenergic receptor agonist
DG01455 beta-Adrenergic receptor agonist
DG01452 beta2-Adrenergic receptor agonist
DG01055 Procaterol
Metabolizing enzyme substrate
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
DG01055 Procaterol
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 45
1 X Cl 41.1454 -16.1616
2 C8y C 27.0814 -15.8115
3 C8y C 27.0814 -17.2109
4 C8y C 28.2709 -17.9106
5 C8y C 29.5304 -17.2109
6 C8x C 29.5304 -15.8115
7 C8x C 28.2709 -15.1118
8 N4x N 25.8919 -17.9106
9 C8y C 25.8919 -19.3100
10 C8x C 27.0814 -20.0097
11 C8x C 28.2709 -19.3100
12 C1c C 30.7199 -17.9106
13 C1c C 31.9793 -17.2109
14 N1b N 33.1688 -17.9106
15 C1c C 34.3583 -17.2109
16 C1a C 35.6178 -17.9106
17 O1a O 30.7199 -19.3100
18 C1b C 31.9793 -15.8115
19 C1a C 34.3583 -15.8115
20 C1a C 30.7199 -15.1118
21 O1a O 25.8919 -15.1118
22 O5x O 24.7024 -20.0097
23 O0 O 41.4952 -18.6100
24 X Cl 41.1454 -16.1616
25 C8y C 27.0814 -15.8115
26 C8y C 27.0814 -17.2109
27 C8y C 28.2709 -17.9106
28 C8y C 29.5304 -17.2109
29 C8x C 29.5304 -15.8115
30 C8x C 28.2709 -15.1118
31 C1c C 30.7199 -17.9106
32 C1c C 31.9793 -17.2109
33 N1b N 33.1688 -17.9106
34 C1c C 34.3583 -17.2109
35 C1a C 35.6178 -17.9106
36 C1a C 34.3583 -15.8115
37 C1b C 31.9793 -15.8115
38 C1a C 30.7199 -15.1118
39 O1a O 30.7199 -19.3100
40 C8x C 28.2709 -19.3100
41 C8x C 27.0814 -20.0097
42 C8y C 25.8919 -19.3100
43 N4x N 25.8919 -17.9106
44 O5x O 24.7024 -20.0097
45 O1a O 25.8919 -15.1118
BOND 44
1 2 3 2
2 3 4 1
3 4 5 2
4 5 6 1
5 6 7 2
6 2 7 1
7 3 8 1
8 8 9 1
9 9 10 1
10 10 11 2
11 4 11 1
12 5 12 1
13 12 13 1
14 13 14 1
15 14 15 1
16 15 16 1
17 12 17 1 #Up
18 13 18 1 #Up
19 15 19 1
20 18 20 1
21 2 21 1
22 9 22 2
23 25 26 2
24 26 27 1
25 27 28 2
26 28 29 1
27 29 30 2
28 25 30 1
29 26 43 1
30 43 42 1
31 42 41 1
32 41 40 2
33 27 40 1
34 28 31 1
35 31 32 1
36 32 33 1
37 33 34 1
38 34 35 1
39 31 39 1 #Up
40 32 37 1 #Up
41 34 36 1
42 37 38 1
43 25 45 1
44 42 44 2
BRACKET 1 39.4100 -17.0100 39.4100 -15.3300
1 42.0700 -15.3300 42.0700 -17.0100
1 2
ORIGINAL 1 1
REPEAT 1 24
2 22.8200 -20.8600 22.8200 -13.5100
2 37.8700 -13.5100 37.8700 -20.8600
2 2
ORIGINAL 2 2 3 4 5 6 7 12 13 14 15 16 19 18 20 17 11
2 10 9 8 22 21
REPEAT 2 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40
2 41 42 43 44 45
|
|---|
