KEGG   DRUG: FluoxetineHelp
Entry
D00326                      Drug                                   

Name
Fluoxetine (USAN/INN);
Fluoxetine (TN)
Formula
C17H18F3NO
Exact mass
309.134
Mol weight
309.3261
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Neuropsychiatric agent
 DG01659  Selective serotonin reuptake inhibitor
Enzyme substrate
 DG01642  CYP2C9 substrate
 DG01644  CYP2D6 substrate
Enzyme inhibitor
 DG01933  CYP2C19 inhibitor
 DG01645  CYP2D6 inhibitor
 DG02852  CYP3A inhibitor
Transporter inhibitor
 DG01622  ABCB1 (P-GP) inhibitor
Remark
ATC code: N06AB03
Chemical structure group: DG00942
Product (DG00942): D00823<US>
Efficacy
Antidepressant, Selective serotonin reuptake inhibitor (SSRI)
Target
SLC6A4 (HTT) [HSA:6532] [KO:K05037]
  Pathway
hsa04726  Serotonergic synapse
Metabolism
Enzyme: CYP2C9 [HSA:1559], CYP2D6 [HSA:1565]
Interaction
CYP inhibition: CYP2C19 [HSA:1557], CYP2D6 [HSA:1565], CYP3A [HSA:1576 1577 1551]
Transporter inhibition: ABCB1 [HSA:5243]
Drug interaction
Structure map
map07027  Antidepressants
map07234  Neurotransmitter transporter inhibitors
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N06 PSYCHOANALEPTICS
   N06A ANTIDEPRESSANTS
    N06AB Selective serotonin reuptake inhibitors
     N06AB03 Fluoxetine
      D00326  Fluoxetine (USAN/INN)
USP drug classification [BR:br08302]
 Antidepressants
  SSRIs/SNRIs (Selective Serotonin Reuptake Inhibitors/Serotonin and Norepinephrine Reuptake Inhibitors)
   Fluoxetine
    D00326  Fluoxetine (USAN/INN)
Target-based classification of drugs [BR:br08310]
 Transporters
  Solute carrier family
   SLC6
    SLC6A4 (HTT)
     D00326  Fluoxetine (USAN/INN)
BRITE hierarchy
Other DBs
CAS: 54910-89-3
PubChem: 7847392
ChEBI: 5118
ChEMBL: CHEMBL41
DrugBank: DB00472
LigandBox: D00326
NIKKAJI: J244.937D
LinkDB All DBs
KCF data Show

ATOM        22
            1   C1c C    19.5445  -17.2645
            2   C8y C    19.5445  -18.6727
            3   O2a O    20.7718  -16.5573
            4   C1b C    18.3175  -16.5573
            5   C8x C    18.3117  -19.3799
            6   C8x C    20.7658  -19.3799
            7   C8y C    21.9931  -17.2645
            8   C1b C    17.1021  -17.2585
            9   C8x C    18.3117  -20.7938
            10  C8x C    20.7658  -20.7938
            11  C8x C    21.9931  -18.6727
            12  C8x C    23.2144  -16.5573
            13  N1b N    15.8748  -16.5515
            14  C8x C    19.5445  -21.5010
            15  C8x C    23.2085  -19.3799
            16  C8x C    24.4357  -17.2645
            17  C1a C    14.6535  -17.2585
            18  C8y C    24.4357  -18.6786
            19  C1d C    25.6568  -19.3856
            20  X   F    26.9717  -20.0226
            21  X   F    26.2471  -18.3863
            22  X   F    24.9673  -20.5193
BOND        23
            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 2
            9     6  10 1
            10    7  11 2
            11    7  12 1
            12    8  13 1
            13    9  14 1
            14   11  15 1
            15   12  16 2
            16   13  17 1
            17   15  18 2
            18   18  19 1
            19   19  20 1
            20   19  21 1
            21   19  22 1
            22   10  14 2
            23   16  18 1

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