KEGG   DRUG: D09866Help
Entry
D09866                      Drug                                   

Name
Atopaxar (USAN)
Formula
C29H38FN3O5
Exact mass
527.2796
Mol weight
527.6275
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Treatment of cardiovascular disorders
Target
coagulation factor II (thrombin) receptor (PAR1) antagonist [HSA:2149] [KO:K03914]
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04610  Complement and coagulation cascades  
 
Brite
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Thrombin
    coagulation factor II (thrombin) receptor (PAR1) [HSA:2149] [KO:K03914]
     Atopaxar
      D09866  Atopaxar (USAN)
BRITE hierarchy
Other DBs
CAS: 
751475-53-3
PubChem: 
LigandBox: 
KCF data Show

ATOM        38
            1   C8y C    11.1300  -21.3500
            2   C8y C    11.1300  -22.7500
            3   C8x C    12.3424  -23.4500
            4   C8y C    13.5549  -22.7500
            5   C8y C    13.5549  -21.3500
            6   C8y C    12.3424  -20.6500
            7   C1x C    14.8864  -23.1826
            8   N1y N    15.7093  -22.0500
            9   C2y C    14.8864  -20.9174
            10  C1b C    17.0800  -22.0500
            11  X   F    12.3424  -19.2502
            12  O2a O     9.9176  -20.6500
            13  C1b C     8.7221  -21.3404
            14  C1a C     7.5347  -20.6549
            15  O2a O     9.9176  -23.4500
            16  C1b C     8.7221  -22.7596
            17  C1a C     7.5347  -23.4451
            18  N2a N    15.3175  -19.5906
            19  C5a C    17.7800  -23.2624
            20  C8y C    19.1800  -23.2624
            21  O5a O    17.0896  -24.4579
            22  C8x C    19.8704  -24.4579
            23  C8y C    21.2704  -24.4578
            24  C8y C    21.9703  -23.2453
            25  C8y C    21.2799  -22.0498
            26  C8x C    19.8799  -22.0499
            27  N1y N    21.9611  -25.6532
            28  C1x C    21.2806  -26.8328
            29  C1x C    21.9810  -28.0450
            30  O2x O    23.3810  -28.0445
            31  C1x C    24.0615  -26.8649
            32  C1x C    23.3611  -25.6527
            33  C1d C    21.9797  -20.8374
            34  O2a O    23.3800  -23.2451
            35  C1a C    24.0779  -24.4537
            36  C1a C    23.3798  -20.8372
            37  C1a C    21.2893  -19.6422
            38  C1a C    22.6797  -19.6249
BOND        41
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 2
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    5   9 1
            11    8  10 1
            12    6  11 1
            13    1  12 1
            14   12  13 1
            15   13  14 1
            16    2  15 1
            17   15  16 1
            18   16  17 1
            19    9  18 2
            20   10  19 1
            21   19  20 1
            22   19  21 2
            23   20  22 1
            24   22  23 2
            25   23  24 1
            26   24  25 2
            27   25  26 1
            28   20  26 2
            29   23  27 1
            30   27  28 1
            31   28  29 1
            32   29  30 1
            33   30  31 1
            34   31  32 1
            35   27  32 1
            36   25  33 1
            37   24  34 1
            38   34  35 1
            39   33  36 1
            40   33  37 1
            41   33  38 1

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