KEGG   DRUG: Olmesartan
Entry
D05246                      Drug                                   
Name
Olmesartan (USAN/INN)
Formula
C24H26N6O3
Exact mass
446.2066
Mol weight
446.50
Structure
Simcomp
Class
Cardiovascular agent
 DG01925  Renin-angiotensin system inhibitor
  DG01495  Angiotensin II receptor antagonist
 DG03231  Antihypertensive
  DG01495  Angiotensin II receptor antagonist
Transporter substrate
 DG01665  ABCB1 substrate
 DG02861  ABCC2 substrate
 DG01913  ABCG2 substrate
Remark
Same as: C21543
Chemical structure group: DG01544
Product (DG01544): D01204<JP/US>
Efficacy
Antihypertensive, Angiotensin II receptor antagonist
Comment
Treatment of hypertension
Target
AGTR1 [HSA:185] [KO:K04166]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04261  Adrenergic signaling in cardiomyocytes
hsa04270  Vascular smooth muscle contraction
hsa04614  Renin-angiotensin system
Metabolism
Transporter: ABCC2 [HSA:1244], ABCB1 [HSA:5243], ABCG2 [HSA:9429]
Interaction
Structure map
map07229  Angiotensin receptor and endothelin receptor antagonists
Other map
map04976  Bile secretion
Brite
Drug groups [BR:br08330]
 Cardiovascular agent
  DG01925  Renin-angiotensin system inhibitor
   DG01495  Angiotensin II receptor antagonist
    DG01544  Olmesartan
     D05246  Olmesartan
  DG03231  Antihypertensive
   DG01495  Angiotensin II receptor antagonist
    DG01544  Olmesartan
     D05246  Olmesartan
 Transporter substrate
  DG01665  ABCB1 substrate
   DG01544  Olmesartan
    D05246  Olmesartan
  DG02861  ABCC2 substrate
   DG01544  Olmesartan
    D05246  Olmesartan
  DG01913  ABCG2 substrate
   DG01544  Olmesartan
    D05246  Olmesartan
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Angiotensin
    AGTR1
     D05246  Olmesartan (USAN/INN)
Drug metabolizing enzymes and transporters [br08309.html]
 Drug transporters
  D05246
Prodrugs [br08324.html]
 D05246
Drug groups [BR:br08330]
 Cardiovascular agent
  DG01925  Renin-angiotensin system inhibitor
   DG01495  Angiotensin II receptor antagonist
    DG01544  Olmesartan
  DG03231  Antihypertensive
   DG01495  Angiotensin II receptor antagonist
    DG01544  Olmesartan
 Transporter substrate
  DG01665  ABCB1 substrate
   DG01544  Olmesartan
  DG02861  ABCC2 substrate
   DG01544  Olmesartan
  DG01913  ABCG2 substrate
   DG01544  Olmesartan
Other DBs
CAS: 144689-24-7
PubChem: 47206963
PDB-CCD: OLM[PDBj]
LigandBox: D05246
NIKKAJI: J715.876I
LinkDB
KCF data

ATOM        33
            1   C1d C    30.1124  -16.1644
            2   C8y C    29.4120  -14.9513
            3   O1a O    29.4120  -17.3776
            4   C6a C    27.3107  -16.1644
            5   O6a O    28.0112  -17.3776
            6   C8y C    28.0112  -14.9513
            7   C1b C    26.3656  -12.9132
            8   C8y C    25.1490  -13.6075
            9   N4y N    27.5753  -13.6198
            10  N5x N    29.8481  -13.6198
            11  C8y C    28.7116  -12.7933
            12  C8x C    23.9417  -12.8984
            13  C8x C    22.7250  -13.5926
            14  C8y C    22.7178  -14.9934
            15  C8x C    23.9275  -15.7000
            16  C8x C    25.1443  -15.0058
            17  C8y C    21.5012  -15.6877
            18  C8y C    20.2956  -14.9759
            19  C8x C    19.0790  -15.6703
            20  C8x C    19.1419  -17.0711
            21  C8x C    20.2815  -17.7776
            22  C8x C    21.4982  -17.0833
            23  C8y C    20.3062  -13.5751
            24  N5x N    21.4481  -12.7573
            25  N5x N    21.0251  -11.4219
            26  N5x N    19.6244  -11.4117
            27  N4x N    19.1816  -12.7405
            28  C1a C    31.0959  -15.1634
            29  C1a C    31.0959  -17.1516
            30  O6a O    25.9099  -16.1644
            31  C1b C    28.7116  -11.3925
            32  C1b C    27.4984  -10.6921
            33  C1a C    26.2851  -11.3925
BOND        36
            1    12  13 1
            2    13  14 2
            3    14  15 1
            4    15  16 2
            5    16   8 1
            6     4   6 1
            7    14  17 1
            8     7   8 1
            9     7   9 1
            10   17  18 2
            11   18  19 1
            12   19  20 2
            13   20  21 1
            14   21  22 2
            15   22  17 1
            16    1   2 1
            17   18  23 1
            18    2  10 1
            19   10  11 2
            20   11   9 1
            21   23  24 2
            22   24  25 1
            23   25  26 2
            24   26  27 1
            25   27  23 1
            26    9   6 1
            27    6   2 2
            28    1  28 1
            29    1   3 1
            30    1  29 1
            31    4  30 2
            32    4   5 1
            33   11  31 1
            34   31  32 1
            35    8  12 2
            36   32  33 1

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