KEGG   DRUG: TiplasininHelp
Entry
D06160                      Drug                                   

Name
Tiplasinin (USAN)
Formula
C24H16F3NO4
Exact mass
439.1031
Mol weight
439.3834
Structure
Mol fileKCF fileDB search
Efficacy
Antiobesity, Plasminogen activator inhibitor-1 (PAI1) inhibitor
Comment
Treatment of fibrinolytic impairment diseases
Target
SERPINE1 (PAI1) [HSA:5054] [KO:K03982]
  Pathway
hsa04218  Cellular senescence
Brite
Target-based classification of drugs [BR:br08310]
 Not elsewhere classified
  Immune system
   Complement and coagulation
    SERPINE1 (PAI1)
     D06160  Tiplasinin (USAN)
BRITE hierarchy
Other DBs
CAS: 393105-53-8
PubChem: 47207818
ChEMBL: CHEMBL325441
LigandBox: D06160
LinkDB All DBs
KCF data Show

ATOM        32
            1   C8y C    18.1345  -15.3363
            2   C8x C    18.1345  -16.7368
            3   C8x C    19.3473  -17.4370
            4   C8y C    20.5603  -16.7368
            5   C8y C    20.5603  -15.3363
            6   C8x C    19.3473  -14.6360
            7   N4y N    21.8923  -17.1695
            8   C8x C    22.7155  -16.0365
            9   C8y C    21.8923  -14.9035
            10  C8y C    16.9217  -14.6360
            11  C8x C    16.9217  -13.2357
            12  C8x C    15.7087  -12.5354
            13  C8y C    14.4959  -13.2357
            14  C8x C    14.4959  -14.6360
            15  C8x C    15.7087  -15.3363
            16  O2a O    13.2809  -12.5342
            17  C1d C    12.0841  -13.2254
            18  X   F    10.8712  -13.9256
            19  X   F    12.7955  -14.4580
            20  X   F    11.3956  -12.0323
            21  C1b C    21.8923  -18.5695
            22  C8y C    23.1093  -19.2723
            23  C8x C    23.1089  -20.6500
            24  C8x C    24.3212  -21.3502
            25  C8x C    25.5338  -20.6505
            26  C8x C    25.5341  -19.2729
            27  C8x C    24.3219  -18.5726
            28  C5a C    21.8923  -13.5035
            29  C6a C    23.1151  -12.7974
            30  O5a O    20.6959  -12.8128
            31  O6a O    24.3216  -13.4939
            32  O6a O    23.1148  -11.4101
BOND        35
            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     4   7 1
            8     7   8 1
            9     8   9 2
            10    5   9 1
            11    1  10 1
            12   10  11 2
            13   11  12 1
            14   12  13 2
            15   13  14 1
            16   14  15 2
            17   10  15 1
            18   13  16 1
            19   16  17 1
            20   17  18 1
            21   17  19 1
            22   17  20 1
            23    7  21 1
            24   21  22 1
            25   22  23 2
            26   23  24 1
            27   24  25 2
            28   25  26 1
            29   26  27 2
            30   22  27 1
            31    9  28 1
            32   28  29 1
            33   28  30 2
            34   29  31 1
            35   29  32 2

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