KEGG   DRUG: Latrepirdine dihydrochlorideHelp
Entry
D09918                      Drug                                   

Name
Latrepirdine dihydrochloride (USAN);
Dimebolin;
Dimebon
Formula
C21H25N3. 2HCl
Exact mass
391.1582
Mol weight
392.3652
Structure
Mol fileKCF fileDB searchJmolKegDraw
Simcomp SIMCOMP
Class
Neuropsychiatric agent
 DG01595  Cholinesterase inhibitor
  DG01593  Acetylcholinesterase inhibitor
 DG01498  NMDA receptor antagonist
 DG01968  Agents for Alzheimer-type dementia
Remark
Chemical group: 
Activity
Dementia therapeutic agent, Acetylcholinesterase inhibitor, NMDA receptor antagonist
Comment
Treatment of Alzheimer's disease
Target
ACHE [HSA:43] [KO:K01049];
GRIN (NMDAR) [HSA:2902 2903 2904 2905 2906] [KO:K05208 K05209 K05210 K05211 K05212];
HRH1 [HSA:3269] [KO:K04149];
HTR6 [HSA:3362] [KO:K04162]
  Pathway
Neuroactive ligand-receptor interaction
Glutamatergic synapse
Cholinergic synapse
Alzheimer's disease
Interaction
Drug interaction
Structure map
Agents for Alzheimer-type dementia
Brite
Target-based classification of drugs [BR:br08310]
 Ion channels
  Glutamate-gated cation channels
   Glutamate (ionotropic), NMDA
    N-methyl-D-aspartate receptor
     Latrepirdine
      D09918  Latrepirdine dihydrochloride (USAN)
 Enzymes
  Hydrolases
   acetylcholinesterase (AChE)
    Latrepirdine
     D09918  Latrepirdine dihydrochloride (USAN)
BRITE hierarchy
Other DBs
CAS: 
97657-92-6
PubChem: 
ChEMBL: 
LigandBox: 
KCF data Show

ATOM        26
            1   X   Cl   30.5200  -20.5100
            2   C8y C    24.2900  -24.1500
            3   C8y C    25.6900  -24.1500
            4   C8y C    26.1100  -22.7500
            5   N4y N    24.9200  -21.9800
            6   C8y C    23.8000  -22.8200
            7   C8x C    26.6700  -25.1300
            8   C8y C    28.0000  -24.7800
            9   C8x C    28.4200  -23.4500
            10  C8x C    27.4400  -22.4000
            11  C1x C    22.4700  -22.6100
            12  C1x C    21.5600  -23.6600
            13  N1y N    22.0500  -24.9900
            14  C1x C    23.3800  -25.2000
            15  C1b C    24.8500  -20.5800
            16  C1b C    26.1100  -19.8100
            17  C8y C    26.1100  -18.4100
            18  C8x C    27.3700  -17.7100
            19  N5x N    27.3700  -16.3100
            20  C8y C    26.1100  -15.6100
            21  C8x C    24.9200  -16.3100
            22  C8x C    24.9200  -17.7100
            23  C1a C    26.1100  -14.2100
            24  C1a C    28.9800  -25.7600
            25  C1a C    21.1400  -26.0400
            26  X   Cl   30.5200  -20.5100
BOND        27
            1     2   3 1
            2     3   4 2
            3     4   5 1
            4     5   6 1
            5     2   6 2
            6     3   7 1
            7     7   8 2
            8     8   9 1
            9     9  10 2
            10    4  10 1
            11    6  11 1
            12   11  12 1
            13   12  13 1
            14   13  14 1
            15    2  14 1
            16    5  15 1
            17   15  16 1
            18   16  17 1
            19   17  18 1
            20   18  19 2
            21   19  20 1
            22   20  21 2
            23   21  22 1
            24   17  22 2
            25   20  23 1
            26    8  24 1
            27   13  25 1
BRACKET     1    29.4000  -21.0700   29.4000  -19.6700
            1    31.1500  -19.6700   31.1500  -21.0700
            1  2
 ORIGINAL  1    1
 REPEAT    1   26

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