KEGG   DRUG: Tarenflurbil
Entry
D09010                      Drug                                   
Name
Tarenflurbil (USAN/INN);
R-Flurbiprofen
Formula
C15H13FO2
Exact mass
244.0900
Mol weight
244.26
Structure
Simcomp
Efficacy
Dementia therapeutic agent, gamma-Secretase inhibitor
Comment
Treatment of Alzheimer's disease
Target
PSEN1/PSENEN/NCSTN/APH1A [HSA:5663 55851 23385 51107] [KO:K04505 K06170 K06171 K06172]
  Pathway
hsa04330  Notch signaling pathway
hsa04722  Neurotrophin signaling pathway
hsa05010  Alzheimer disease
Structure map
map07056  Agents for Alzheimer-type dementia
Brite
Target-based classification of drugs [BR:br08310]
 Enzymes
  Hydrolases (EC3)
   Aspartic peptidases
    PSEN1/PSENEN/NCSTN/APH1A
     D09010  Tarenflurbil (USAN/INN)
Other DBs
CAS: 51543-40-9
PubChem: 96025693
PDB-CCD: FLR[PDBj]
LigandBox: D09010
NIKKAJI: J261.753F
LinkDB
KCF data

ATOM        18
            1   C8x C    16.1000  -15.8900
            2   C8x C    16.1000  -17.2900
            3   C8x C    17.3124  -17.9900
            4   C8x C    18.5249  -17.2900
            5   C8y C    18.5249  -15.8900
            6   C8x C    17.3124  -15.1900
            7   C8y C    19.7560  -15.1790
            8   C8y C    20.9612  -15.8747
            9   C8x C    22.1735  -15.1746
            10  C8y C    22.1735  -13.7746
            11  C8x C    20.9683  -13.0789
            12  C8x C    19.7559  -13.7790
            13  C1c C    23.3914  -13.0712
            14  C6a C    24.6034  -13.7707
            15  O6a O    25.7823  -13.0898
            16  O6a O    24.6040  -15.1896
            17  C1a C    23.3911  -11.6900
            18  X   F    20.9616  -17.2896
BOND        19
            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     5   7 1
            8     7   8 2
            9     8   9 1
            10    9  10 2
            11   10  11 1
            12   11  12 2
            13    7  12 1
            14   10  13 1
            15   13  14 1
            16   14  15 1
            17   14  16 2
            18   13  17 1 #Up
            19    8  18 1

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