| Entry |
|
|---|
| Name |
Pantoprazole (USAN/INN) |
|---|
| Formula |
C16H15F2N3O4S
|
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| Exact mass |
383.0751
|
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| Mol weight |
383.3698
|
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| Structure |
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| Simcomp |
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| Class |
Gastrointestinal agent
DG01975 Agents for peptic ulcer
DG01646 Proton pump inhibitor (PPI)
Metabolizing enzyme substrate
DG01639 CYP2C19 substrate
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
|
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| Remark |
| Product (DG00021): | D02593<US> |
|
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| Efficacy |
Anti-ulcerative, Proton pump inhibitor |
|---|
| Comment |
Benzimidazole derivative
|
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| Target |
|
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| Pathway |
|
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| Metabolism |
Enzyme: CYP2C19 [HSA: 1557]; CYP3A4 [HSA: 1576]
|
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| Interaction |
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| Structure map |
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| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
A ALIMENTARY TRACT AND METABOLISM
A02 DRUGS FOR ACID RELATED DISORDERS
A02B DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
A02BC Proton pump inhibitors
A02BC02 Pantoprazole
D05353 Pantoprazole (USAN/INN)
Drug groups [BR:br08330]
Gastrointestinal agent
DG01975 Agents for peptic ulcer
DG01646 Proton pump inhibitor (PPI)
DG00021 Pantoprazole
D05353 Pantoprazole
Metabolizing enzyme substrate
DG01639 CYP2C19 substrate
DG00021 Pantoprazole
D05353 Pantoprazole
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
DG00021 Pantoprazole
D05353 Pantoprazole
Target-based classification of drugs [BR:br08310]
Enzymes
Hydrolases (EC3)
ATPase
ATP4
D05353 Pantoprazole (USAN/INN)
Drug metabolizing enzymes and transporters [br08309.html]
Drug metabolizing enzymes
D05353
Drug groups [BR:br08330]
Gastrointestinal agent
DG01975 Agents for peptic ulcer
DG01646 Proton pump inhibitor (PPI)
DG00021 Pantoprazole
Metabolizing enzyme substrate
DG01639 CYP2C19 substrate
DG00021 Pantoprazole
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
DG00021 Pantoprazole
|
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| Other DBs |
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| KCF data |
ATOM 26
1 C8x C 13.5800 -22.8200
2 C8y C 13.5800 -24.2200
3 C8x C 14.7924 -24.9200
4 C8y C 16.0049 -24.2200
5 C8y C 16.0049 -22.8200
6 C8x C 14.7924 -22.1200
7 N5x N 17.3364 -24.6526
8 C8y C 18.1593 -23.5200
9 N4x N 17.3364 -22.3874
10 S4a S 19.5300 -23.5200
11 C1b C 20.2300 -24.7324
12 O3c O 20.2300 -22.3076
13 O2a O 12.3676 -24.9200
14 C1c C 11.1721 -24.2296
15 X F 9.9847 -24.9151
16 X F 11.1720 -22.8203
17 C8y C 21.6298 -24.7324
18 C8y C 22.3203 -25.9280
19 C8y C 23.7203 -25.9278
20 C8x C 24.4201 -24.7153
21 C8x C 23.7297 -23.5198
22 N5x N 22.3297 -23.5199
23 O2a O 21.6349 -27.1152
24 C1a C 20.2302 -27.1154
25 O2a O 24.4110 -27.1232
26 C1a C 25.8296 -27.1232
BOND 28
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 8 10 1
12 10 11 1
13 10 12 2
14 2 13 1
15 13 14 1
16 14 15 1
17 14 16 1
18 11 17 1
19 17 18 2
20 18 19 1
21 19 20 2
22 20 21 1
23 21 22 2
24 17 22 1
25 18 23 1
26 23 24 1
27 19 25 1
28 25 26 1
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