KEGG   DRUG: Sotagliflozin
Entry
D10669                      Drug                                   
Name
Sotagliflozin (USAN/INN);
Inpefa (TN)
Product
INPEFA (Lexicon Pharmaceuticals)
Formula
C21H25ClO5S
Exact mass
424.1111
Mol weight
424.9382
Structure
Simcomp
Class
Antidiabetic agent
 DG02044  Hypoglycemic agent
  DG01794  SGLT2 inhibitor
Metabolizing enzyme substrate
 DG01633  CYP3A/CYP3A4 substrate
  DG02913  CYP3A4 substrate
 DG02924  UGT substrate
  DG03188  UGT1A9 substrate
Remark
ATC code: A10BK06
Product: D10669<US>
Efficacy
SGLT inhibitor
Comment
Phlorizin derivative
Treatment of heart failure
Target
SLC5A1 (SGLT1) [HSA:6523] [KO:K14158]
SLC5A2 (SGLT2) [HSA:6524] [KO:K14382]
  Pathway
hsa04973  Carbohydrate digestion and absorption
hsa04976  Bile secretion
hsa04978  Mineral absorption
Metabolism
Enzyme: UGT1A9 [HSA:54600]; CYP3A4 [HSA:1576]
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
    A10BK Sodium-glucose co-transporter 2 (SGLT2) inhibitors
     A10BK06 Sotagliflozin
      D10669  Sotagliflozin (USAN/INN) <US>
USP drug classification [BR:br08302]
 Cardiovascular Agents
  Sodium-Glucose Co-Transporter 2 Inhibitors (SGLT2i)
   Sotagliflozin
    D10669  Sotagliflozin (USAN/INN)
Drug groups [BR:br08330]
 Antidiabetic agent
  DG02044  Hypoglycemic agent
   DG01794  SGLT2 inhibitor
    D10669  Sotagliflozin
 Metabolizing enzyme substrate
  DG01633  CYP3A/CYP3A4 substrate
   DG02913  CYP3A4 substrate
    D10669  Sotagliflozin
  DG02924  UGT substrate
   DG03188  UGT1A9 substrate
    D10669  Sotagliflozin
Target-based classification of drugs [BR:br08310]
 Transporters
  Solute carrier family
   SLC5
    SLC5A1 (SGLT1)
     D10669  Sotagliflozin (USAN/INN) <US>
    SLC5A2 (SGLT2)
     D10669  Sotagliflozin (USAN/INN) <US>
New drug approvals in the USA [br08319.html]
 New molecular entities and new therapeutic biological products
  D10669
New drug approvals in Europe [br08329.html]
 European public assessment reports (EPAR) authorised medicine
  D10669
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D10669
Drug metabolizing enzymes and transporters [br08309.html]
 Drug metabolizing enzymes
  D10669
Other DBs
CAS: 1018899-04-1
PubChem: 254741630
ChEBI: 229226
PDB-CCD: LFL[PDBj]
LinkDB
KCF data

ATOM        28
            1   C1y C    14.4200  -16.8000
            2   O2x O    14.4200  -15.4000
            3   C1y C    13.1600  -14.7000
            4   C1y C    11.9700  -15.4000
            5   C1y C    11.9700  -16.8000
            6   C1y C    13.1600  -17.5000
            7   C8x C    21.6300  -19.7400
            8   C8y C    22.8200  -19.0400
            9   C8x C    22.8200  -17.6400
            10  C8x C    21.7000  -16.9400
            11  C8y C    20.4400  -17.6400
            12  C8x C    20.4400  -18.9700
            13  C8y C    18.0600  -18.9700
            14  C8y C    18.0600  -17.5700
            15  C8x C    16.8700  -16.8000
            16  C8y C    15.6100  -17.5000
            17  C8x C    15.6100  -18.9000
            18  C8x C    16.8000  -19.6700
            19  C1b C    19.2500  -16.8700
            20  O2a O    24.0800  -19.7400
            21  C1b C    25.2700  -19.0400
            22  C1a C    26.4600  -19.7400
            23  X   Cl   19.3200  -19.6700
            24  S2a S    13.1600  -13.3000
            25  C1a C    14.4200  -12.6000
            26  O1a O    10.7800  -14.7000
            27  O1a O    10.7800  -17.5000
            28  O1a O    13.1600  -18.9000
BOND        30
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     7   8 2
            8     8   9 1
            9     9  10 2
            10   10  11 1
            11   11  12 2
            12    7  12 1
            13   13  14 2
            14   14  15 1
            15   15  16 2
            16   16  17 1
            17   17  18 2
            18   13  18 1
            19   14  19 1
            20   11  19 1
            21    8  20 1
            22   20  21 1
            23   21  22 1
            24   13  23 1
            25    1  16 1 #Up
            26    3  24 1 #Up
            27   24  25 1
            28    4  26 1 #Down
            29    5  27 1 #Up
            30    6  28 1 #Down

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