KEGG   DRUG: Diclofenac potassium
Entry
D00903                      Drug                                   

Name
Diclofenac potassium (USP);
Cambia (TN);
Cataflam (TN);
Zipsor (TN)
Product
  Generic
Formula
C14H10Cl2NO2. K
Exact mass
332.9726
Mol weight
334.239
Structure
Simcomp
Class
Anti-inflammatory
 DG01906  Anti-inflammatory drug, acetic acid derivatives
  DG01898  Anti-inflammatory drug, phenylacetic acid derivatives
 DG01504  Nonsteroidal anti-inflammatory drug (NSAID)
  DG01906  Anti-inflammatory drug, acetic acid derivatives
   DG01898  Anti-inflammatory drug, phenylacetic acid derivatives
Metabolizing enzyme substrate
 DG01642  CYP2C9 substrate
Transporter inhibitor
 DG02866  SLC22A8 (OAT3) inhibitor
Remark
ATC code: D11AX18 M01AB05 M02AA15 S01BC03
Chemical structure group: DG00441
Product (DG00441): D07816<US> D00903<US> D00904<JP/US> D07818<US>
Efficacy
Anti-inflammatory, COX inhibitor
Target
PTGS1 (COX1) [HSA:5742] [KO:K00509]
PTGS2 (COX2) [HSA:5743] [KO:K11987]
  Pathway
hsa00590  Arachidonic acid metabolism
Metabolism
Enzyme: CYP2C9 [HSA:1559]
Interaction
Transporter inhibition: SLC22A8 [HSA:9376]
Structure map
map07219  Cyclooxygenase inhibitors
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 D DERMATOLOGICALS
  D11 OTHER DERMATOLOGICAL PREPARATIONS
   D11A OTHER DERMATOLOGICAL PREPARATIONS
    D11AX Other dermatologicals
     D11AX18 Diclofenac
      D00903  Diclofenac potassium (USP) <US>
 M MUSCULO-SKELETAL SYSTEM
  M01 ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
   M01A ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
    M01AB Acetic acid derivatives and related substances
     M01AB05 Diclofenac
      D00903  Diclofenac potassium (USP) <US>
  M02 TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
   M02A TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
    M02AA Antiinflammatory preparations, non-steroids for topical use
     M02AA15 Diclofenac
      D00903  Diclofenac potassium (USP) <US>
 S SENSORY ORGANS
  S01 OPHTHALMOLOGICALS
   S01B ANTIINFLAMMATORY AGENTS
    S01BC Antiinflammatory agents, non-steroids
     S01BC03 Diclofenac
      D00903  Diclofenac potassium (USP) <US>
USP drug classification [BR:br08302]
 Analgesics
  Nonsteroidal Anti-inflammatory Drugs
   Diclofenac
    D00903  Diclofenac potassium (USP)
 Dermatological Agents
  Dermatological Agents, Other
   Warts and Actinic Keratosis Agents
    Diclofenac
     D00903  Diclofenac potassium (USP)
 Ophthalmic Agents
  Ophthalmic Anti-inflammatories
   Nonsteroidal Anti-Inflammatory Drugs, Ophthalmic
    Diclofenac
     D00903  Diclofenac potassium (USP)
Target-based classification of drugs [BR:br08310]
 Enzymes
  Oxidoreductases (EC1)
   Prostaglandin synthase
    PTGS1 (COX1)
     D00903  Diclofenac potassium (USP) <US>
    PTGS2 (COX2)
     D00903  Diclofenac potassium (USP) <US>
Drug metabolizing enzymes and transporters [br08309.html]
 Drug metabolizing enzymes
  D00903
 Drug transporters
  D00903
Other DBs
CAS: 15307-81-0
PubChem: 7847967
ChEBI: 4508
ChEMBL: CHEMBL1200804
DrugBank: DB00586
LigandBox: D00903
NIKKAJI: J435.105C
LinkDB
KCF data

ATOM        20
            1   Z   K    45.1317  -36.4561 #+
            2   C8x C    37.3100  -37.1000
            3   C8x C    37.3100  -38.5000
            4   C8x C    38.5224  -39.2000
            5   C8x C    39.7349  -38.5000
            6   C8y C    39.7349  -37.1000
            7   C8y C    38.5224  -36.4000
            8   C1b C    40.9660  -36.3890
            9   C6a C    42.1712  -37.0847
            10  O6a O    43.3535  -36.4019 #-
            11  O6a O    42.1716  -38.4996
            12  N1b N    38.5224  -35.0002
            13  C8y C    37.2932  -34.2903
            14  C8y C    37.2935  -32.9001
            15  C8x C    36.0812  -32.1999
            16  C8x C    34.8686  -32.8996
            17  C8x C    34.8683  -34.2898
            18  C8y C    36.0806  -34.9901
            19  X   Cl   38.5184  -32.1931
            20  X   Cl   36.0806  -36.3997
BOND        20
            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     6   8 1
            8     8   9 1
            9     9  10 1
            10    9  11 2
            11    7  12 1
            12   12  13 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   18  20 1

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