KEGG   DRUG: Ketoprofen lysine
Entry
D08102                      Drug                                   

Name
Ketoprofen lysine;
Artrosilene (TN)
Formula
C16H14O3. C6H14N2O2
Exact mass
400.1998
Mol weight
400.4681
Structure
Class
Anti-inflammatory
 DG01908  Anti-inflammatory drug, propionic acid derivatives
 DG01504  Nonsteroidal anti-inflammatory drug (NSAID)
  DG01908  Anti-inflammatory drug, propionic acid derivatives
Transporter inhibitor
 DG02883  SLC22A7 (OAT2) inhibitor
Remark
ATC code: M01AE03 M02AA10
Chemical structure group: DG00753
Product (DG00753): D00132<JP/US>
Efficacy
Analgesic, Anti-inflammatory, Antipyretic, COX inhibitor
Comment
Propionic acid derivative
Target
PTGS1 (COX1) [HSA:5742] [KO:K00509]
PTGS2 (COX2) [HSA:5743] [KO:K11987]
  Pathway
hsa00590  Arachidonic acid metabolism
Interaction
Transporter inhibition: SLC22A7 [HSA:10864]
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 M MUSCULO-SKELETAL SYSTEM
  M01 ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
   M01A ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
    M01AE Propionic acid derivatives
     M01AE03 Ketoprofen
      D08102  Ketoprofen lysine
  M02 TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
   M02A TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
    M02AA Antiinflammatory preparations, non-steroids for topical use
     M02AA10 Ketoprofen
      D08102  Ketoprofen lysine
Target-based classification of drugs [BR:br08310]
 Enzymes
  Oxidoreductases (EC1)
   Prostaglandin synthase
    PTGS1 (COX1)
     D08102  Ketoprofen lysine
    PTGS2 (COX2)
     D08102  Ketoprofen lysine
Drug metabolizing enzymes and transporters [br08309.html]
 Drug transporters
  D08102
Other DBs
CAS: 57469-78-0
PubChem: 96024792
LigandBox: D08102
LinkDB
KCF data

ATOM        29
            1   C8x C    14.4929  -18.3441
            2   C8x C    14.4929  -19.7444
            3   C8x C    15.6831  -20.4446
            4   C8x C    16.9434  -19.7444
            5   C8y C    16.9434  -18.3441
            6   C8x C    15.6831  -17.6440
            7   C8x C    19.3240  -19.7444
            8   C8y C    19.3240  -18.3441
            9   C5a C    18.1337  -17.6440
            10  C8x C    20.5843  -20.4446
            11  C8x C    21.7745  -19.7444
            12  C8y C    21.7745  -18.3441
            13  C8x C    20.5843  -17.6440
            14  O5a O    18.1337  -16.2436
            15  C1c C    22.9648  -17.6440
            16  C6a C    24.1551  -18.3441
            17  C1a C    22.9648  -16.2436
            18  O6a O    25.3454  -17.6440
            19  O6a O    24.1551  -19.7444
            20  O6a O    29.7564  -18.5542
            21  C6a C    30.9691  -17.8540
            22  C1c C    32.1818  -18.5542
            23  C1b C    33.3945  -17.8540
            24  C1b C    34.6072  -18.5542
            25  C1b C    35.8200  -17.8540
            26  C1b C    37.0327  -18.5542
            27  N1a N    38.2453  -17.8540
            28  O6a O    30.9691  -16.4539
            29  N1a N    32.1818  -19.9543
BOND        29
            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     7   8 1
            8     8   9 1
            9     5   9 1
            10    7  10 2
            11   10  11 1
            12   11  12 2
            13   12  13 1
            14    8  13 2
            15    9  14 2
            16   12  15 1
            17   15  16 1
            18   15  17 1
            19   16  18 1
            20   16  19 2
            21   20  21 1
            22   21  22 1
            23   22  23 1
            24   23  24 1
            25   24  25 1
            26   25  26 1
            27   26  27 1
            28   21  28 2
            29   22  29 1 #Down

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