KEGG   DRUG: Saxagliptin hydrochlorideHelp
Entry
D10262                      Drug                                   

Name
Saxagliptin hydrochloride;
Onglyza (TN)
Product
Formula
C18H25N3O2. HCl
Exact mass
351.1714
Mol weight
351.8709
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Antidiabetic agent
 DG01601  DPP-4 inhibitor
 DG02044  Hypoglycemics
  DG01601  DPP-4 inhibitor
Metabolizing enzyme substrate
 DG02913  CYP3A4 substrate
 DG02925  CYP3A5 substrate
Remark
ATC code: A10BH03
Chemical structure group: DG00119
Product (DG00119): D09753<JP> D10262<US>
Product (mixture): D10263<US>
Efficacy
Antidiabetic, Dipeptidyl peptidase-4 (DPP-4) inhibitor
Comment
Treatment of type II diabetes mellitus and metabolic syndrome
Target
DPP4 (CD26) [HSA:1803] [KO:K01278]
  Pathway
hsa04974  Protein digestion and absorption
Metabolism
Enzyme: CYP3A4 [HSA:1576], CYP3A5 [HSA:1577]
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 A ALIMENTARY TRACT AND METABOLISM
  A10 DRUGS USED IN DIABETES
   A10B BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
    A10BH Dipeptidyl peptidase 4 (DPP-4) inhibitors
     A10BH03 Saxagliptin
      D10262  Saxagliptin hydrochloride <US>
USP drug classification [BR:br08302]
 Blood Glucose Regulators
  Antidiabetic Agents
   Saxagliptin
    D10262  Saxagliptin hydrochloride
Target-based classification of drugs [BR:br08310]
 Enzymes
  Hydrolases (EC3)
   Peptidyl-peptidases
    DPP4 (CD26)
     D10262  Saxagliptin hydrochloride <US>
New drug approvals in the USA [br08319.html]
 New molecular entities and new therapeutic biological products
  D10262
New drug approvals in Europe [br08329.html]
 European public assessment reports (EPAR) authorised medicine
  D10262
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D10262
BRITE hierarchy
Other DBs
CAS: 709031-78-7
PubChem: 163312293
ChEMBL: CHEMBL1201743
LinkDB All DBs
KCF data Show

ATOM        24
            1   C1z C    19.3200  -17.4300
            2   C1x C    18.6200  -18.8300
            3   C1y C    18.6200  -20.0900
            4   C1y C    18.1300  -19.3900
            5   C1z C    20.4400  -19.3900
            6   C1x C    17.0800  -20.5100
            7   C1x C    19.7400  -21.0700
            8   C1x C    18.1300  -18.0600
            9   C1x C    19.3200  -20.0200
            10  C1x C    20.4400  -18.0600
            11  C1c C    19.3200  -16.0300
            12  C5a C    20.5100  -15.4000
            13  N1a N    18.1300  -15.4000
            14  N1y N    21.7000  -16.0300
            15  O5a O    20.5100  -14.0000
            16  C1y C    22.1200  -17.3600
            17  C1y C    23.5200  -17.3600
            18  C1x C    23.9400  -15.9600
            19  C1y C    22.7500  -15.2600
            20  C3b C    22.7500  -13.8600
            21  N3a N    22.7500  -12.4600
            22  O1a O    21.7700  -19.3900
            23  C1x C    22.8200  -18.5500
            24  X   Cl   27.2300  -19.8100
BOND        27
            1     1   2 1
            2     2   3 1
            3     8   4 1
            4     4   9 1
            5     9   5 1
            6     5  10 1
            7    10   1 1
            8     1   8 1
            9     3   6 1
            10    3   7 1
            11    4   6 1
            12    5   7 1
            13    1  11 1
            14   11  12 1
            15   11  13 1 #Down
            16   12  14 1
            17   12  15 2
            18   14  16 1
            19   16  17 1
            20   17  18 1
            21   18  19 1
            22   14  19 1
            23   19  20 1 #Down
            24   20  21 3
            25    5  22 1
            26   17  23 1
            27   23  16 1

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