KEGG   DRUG: Disulfiram
Entry
D00131                      Drug                                   
Name
Disulfiram (JP18/USP/INN);
Antabuse (TN)
Product
  Generic
Formula
C10H20N2S4
Exact mass
296.0509
Mol weight
296.5392
Structure
Simcomp
Class
Metabolizing enzyme inhibitor
 DG01634  CYP1A2 inhibitor
 DG02884  CYP2E1 inhibitor
Remark
Same as: C01692
Therapeutic category: 3939
ATC code: N07BB01 P03AA04
Product: D00131<JP/US>
Efficacy
Antialcohol dependence, Aldehyde dehydrogenase inhibitor
  Disease
Management of selected chronic alcohol patients [DS:H01611]
Target
ALDH [HSA:217 219 224] [KO:K00128]
  Pathway
hsa00010  Glycolysis / Gluconeogenesis
hsa00071  Fatty acid degradation
hsa00620  Pyruvate metabolism
Interaction
CYP inhibition: CYP2E1 [HSA:1571], CYP1A2 [HSA:1544]
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N07 OTHER NERVOUS SYSTEM DRUGS
   N07B DRUGS USED IN ADDICTIVE DISORDERS
    N07BB Drugs used in alcohol dependence
     N07BB01 Disulfiram
      D00131  Disulfiram (JP18/USP/INN) <JP/US>
 P ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
  P03 ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
   P03A ECTOPARASITICIDES, INCL. SCABICIDES
    P03AA Sulfur containing products
     P03AA04 Disulfiram
      D00131  Disulfiram (JP18/USP/INN) <JP/US>
USP drug classification [BR:br08302]
 Anti-Addiction/Substance Abuse Treatment Agents
  Alcohol Deterrents/Anti-craving
   Disulfiram
    D00131  Disulfiram (JP18/USP/INN)
Therapeutic category of drugs in Japan [BR:br08301]
 3  Agents affecting metabolism
  39  Other agents affecting metabolism
   393  Habitual intoxication agents
    3939  Others
     D00131  Disulfiram (JP18/USP/INN)
Drug groups [BR:br08330]
 Metabolizing enzyme inhibitor
  DG01634  CYP1A2 inhibitor
   D00131  Disulfiram
  DG02884  CYP2E1 inhibitor
   D00131  Disulfiram
Target-based classification of drugs [BR:br08310]
 Enzymes
  Oxidoreductases (EC1)
   Dehydrogenases
    ALDH
     D00131  Disulfiram (JP18/USP/INN) <JP/US>
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00131  Disulfiram
Drug metabolizing enzymes and transporters [br08309.html]
 Drug metabolizing enzymes
  D00131
Other DBs
CAS: 97-77-8
PubChem: 7847199
ChEBI: 4659
LigandBox: D00131
NIKKAJI: J3.980B
LinkDB
KCF data

ATOM        16
            1   N1c N    18.9962  -16.1700
            2   C2c C    20.2135  -16.8721
            3   C1b C    17.7852  -16.8721
            4   C1b C    18.9962  -14.7723
            5   S3a S    21.4244  -16.1700
            6   S0  S    20.2135  -18.2762
            7   C1a C    16.5743  -16.1700
            8   C1a C    17.7852  -14.0703
            9   S3a S    22.8221  -16.1636
            10  C2c C    24.0265  -16.8656
            11  N1c N    25.2438  -16.1700
            12  S0  S    24.0200  -18.2633
            13  C1b C    26.4548  -16.8721
            14  C1b C    25.2438  -14.7659
            15  C1a C    27.6657  -16.1764
            16  C1a C    26.4611  -14.0703
BOND        15
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     4   8 1
            8     5   9 1
            9     9  10 1
            10   10  11 1
            11   10  12 2
            12   11  13 1
            13   11  14 1
            14   13  15 1
            15   14  16 1

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