KEGG   DRUG: Eribaxaban
Entry
D08913                      Drug                                   

Name
Eribaxaban (USAN)
Formula
C24H22ClFN4O4
Exact mass
484.1314
Mol weight
484.9073
Structure
Class
Cardiovascular agent
 DG01662  Factor Xa inhibitor
 DG01950  Antithrombotic agent
  DG01662  Factor Xa inhibitor
Efficacy
Antithrombotic, Factor Xa inhibitor
Comment
Treatment of thromboembolic disorders
Target
F10 [HSA:2159] [KO:K01314]
  Pathway
hsa04610  Complement and coagulation cascades
Interaction
Brite
Target-based classification of drugs [BR:br08310]
 Enzymes
  Hydrolases (EC3)
   Serine peptidases
    F10
     D08913  Eribaxaban (USAN)
Other DBs
CAS: 536748-46-6
PubChem: 96025596
ChEBI: 140420
ChEMBL: CHEMBL476186
PDB-CCD: 230[PDBj]
LigandBox: D08913
LinkDB
KCF data

ATOM        34
            1   C8x C    17.3718  -14.7105
            2   C8y C    17.3718  -16.1114
            3   C8x C    18.5850  -16.8119
            4   C8y C    19.7984  -16.1114
            5   C8y C    19.7984  -14.7105
            6   C8x C    18.5850  -14.0100
            7   N1b N    21.0303  -13.9990
            8   C5a C    22.2363  -14.6952
            9   C1y C    23.4194  -14.0119
            10  N1y N    24.6788  -14.5726
            11  C1x C    25.6013  -13.5480
            12  C1y C    24.9120  -12.3541
            13  C1x C    23.5635  -12.6408
            14  C5a C    24.6788  -15.9735
            15  N1b N    25.8920  -16.6740
            16  C8y C    27.1253  -15.9618
            17  C8x C    28.3299  -16.6572
            18  C8x C    29.5431  -15.9567
            19  C8y C    29.5431  -14.5558
            20  C8x C    28.3384  -13.8603
            21  C8x C    27.1252  -14.5609
            22  X   Cl   30.7625  -13.8515
            23  O5a O    23.4501  -16.6831
            24  O5a O    22.2368  -16.1110
            25  X   F    21.0303  -16.8229
            26  N4y N    16.1586  -16.8119
            27  C8x C    14.9623  -16.1210
            28  C8x C    13.7490  -16.8213
            29  C8x C    13.7488  -18.2222
            30  C8x C    14.9451  -18.9131
            31  C8y C    16.1584  -18.2128
            32  O5x O    17.3884  -18.9233
            33  O2a O    25.4955  -11.0438
            34  C1a C    26.8708  -10.8995
BOND        37
            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 1
            9     9   8 1 #Up
            10    9  10 1
            11   10  11 1
            12   11  12 1
            13   12  13 1
            14    9  13 1
            15   10  14 1
            16   14  15 1
            17   15  16 1
            18   16  17 2
            19   17  18 1
            20   18  19 2
            21   19  20 1
            22   20  21 2
            23   16  21 1
            24   19  22 1
            25   14  23 2
            26    8  24 2
            27    4  25 1
            28    2  26 1
            29   26  27 1
            30   27  28 2
            31   28  29 1
            32   29  30 2
            33   30  31 1
            34   26  31 1
            35   31  32 2
            36   12  33 1 #Up
            37   33  34 1

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