KEGG   DRUG: Bimatoprost grenod
Entry
D12599                      Drug                                   
Name
Bimatoprost grenod (USAN)
Formula
C31H46N2O8
Exact mass
574.3254
Mol weight
574.7055
Structure
Class
Hormonal agent
 DG01961  Prostaglandin derivative
  DG01960  Prostaglandin F derivative
Ophthalmic agent
 DG03201  Intraocular pressure lowering agent
Remark
ATC code: S01EE03
Chemical structure group: DG03267
Product (DG03267): D02724<JP/US>
Efficacy
Antiglaucoma
Comment
Treatment of glaucoma and ocular hypertension
Target
PTGFR [HSA:5737] [KO:K04262]
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 S SENSORY ORGANS
  S01 OPHTHALMOLOGICALS
   S01E ANTIGLAUCOMA PREPARATIONS AND MIOTICS
    S01EE Prostaglandin analogues
     S01EE03 Bimatoprost
      D12599  Bimatoprost grenod (USAN)
Drug groups [BR:br08330]
 Hormonal agent
  DG01961  Prostaglandin derivative
   DG01960  Prostaglandin F derivative
    DG03267  Bimatoprost
     D12599  Bimatoprost grenod
 Ophthalmic agent
  DG03201  Intraocular pressure lowering agent
   DG03267  Bimatoprost
    D12599  Bimatoprost grenod
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Prostaglandin
    PTGFR
     D12599  Bimatoprost grenod (USAN)
Drug groups [BR:br08330]
 Hormonal agent
  DG01961  Prostaglandin derivative
   DG01960  Prostaglandin F derivative
    DG03267  Bimatoprost
 Ophthalmic agent
  DG03201  Intraocular pressure lowering agent
   DG03267  Bimatoprost
Other DBs
CAS: 1194396-71-8
LinkDB
KCF data

ATOM        41
            1   C1y C    13.5117  -15.1219
            2   C1y C    13.5117  -13.7217
            3   C1y C    12.1815  -13.3016
            4   C1x C    11.3414  -14.4218
            5   C1y C    12.1815  -15.5419
            6   O1a O    11.7614  -11.9715
            7   O1a O    11.7614  -16.8721
            8   C1b C    14.7718  -13.0216
            9   C2b C    15.9620  -13.7217
            10  C2b C    14.7718  -15.8219
            11  C2b C    15.9620  -15.1219
            12  C1c C    17.1521  -15.8219
            13  C1b C    18.4123  -15.1219
            14  C1b C    19.6024  -15.8219
            15  C2b C    17.3621  -13.7217
            16  C1b C    18.6223  -13.0216
            17  C1b C    19.8124  -13.7217
            18  C1b C    21.0026  -13.0216
            19  C5a C    22.2627  -13.7217
            20  N1b N    23.4529  -13.0216
            21  C1b C    24.6430  -13.7217
            22  O7a O    17.1521  -17.2221
            23  C8y C    19.6024  -17.2221
            24  C8x C    18.4123  -17.9222
            25  C8x C    18.4123  -19.3224
            26  C8x C    19.6024  -20.0225
            27  C8x C    20.7925  -19.3224
            28  C8x C    20.7925  -17.9222
            29  O5a O    22.2627  -15.1219
            30  C1a C    25.9032  -13.0216
            31  C7a C    15.9390  -17.9225
            32  O6a O    14.7414  -17.2309
            33  C1b C    15.9390  -19.3198
            34  C1b C    14.7423  -20.0108
            35  C1b C    14.7422  -21.4197
            36  C1b C    13.5506  -22.1078
            37  C1b C    13.5506  -23.5078
            38  O2a O    12.3553  -24.1983
            39  N2b N    11.1781  -23.5191 #+
            40  O3a O     9.8420  -24.3503 #-
            41  O3a O    11.1776  -22.1202
BOND        42
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     1   5 1
            6     3   6 1 #Down
            7     5   7 1 #Down
            8     2   8 1 #Down
            9     8   9 1
            10    1  10 1 #Up
            11   10  11 2
            12   11  12 1
            13   12  13 1
            14   13  14 1
            15    9  15 2
            16   15  16 1
            17   16  17 1
            18   17  18 1
            19   18  19 1
            20   19  20 1
            21   20  21 1
            22   12  22 1 #Down
            23   14  23 1
            24   23  24 2
            25   24  25 1
            26   25  26 2
            27   26  27 1
            28   27  28 2
            29   23  28 1
            30   19  29 2
            31   21  30 1
            32   22  31 1
            33   31  32 2
            34   31  33 1
            35   33  34 1
            36   34  35 1
            37   35  36 1
            38   36  37 1
            39   37  38 1
            40   38  39 1
            41   39  40 1
            42   39  41 2

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