KEGG   DRUG: OspemifeneHelp
Entry
D08958                      Drug                                   

Name
Ospemifene (INN/USAN/BAN);
Osphena (TN)
Product
Formula
C24H23ClO2
Exact mass
378.1387
Mol weight
378.8912
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Other
 DG01619  Clomifene and tamoxifen derivative
  DG01621  Cloimifene-type osteoporosis agent
Remark
ATC code: G03XC05
Product: D08958<US>
Efficacy
Osteoporosis agent, Selective estrogen receptor modulator (SERM)
Comment
Clomifene, tamoxifen derivative
Treatment of vaginal atrophy, osteoporosis, and vasomotor symptoms
Target
NR3A1 (ESR1) [HSA:2099] [KO:K08550]
  Pathway
hsa04915  Estrogen signaling pathway
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 G GENITO URINARY SYSTEM AND SEX HORMONES
  G03 SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
   G03X OTHER SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
    G03XC Selective estrogen receptor modulators
     G03XC05 Ospemifene
      D08958  Ospemifene (INN/USAN/BAN) <US>
USP drug classification [BR:br08302]
 Hormonal Agents, Stimulant/Replacement/Modifying (Sex Hormones/Modifiers)
  Selective Estrogen Receptor Modifying Agents
   Ospemifene
    D08958  Ospemifene (INN/USAN/BAN)
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   Estrogen receptor
    NR3A1 (ESR1)
     D08958  Ospemifene (INN/USAN/BAN) <US>
New drug approvals in the USA [br08319.html]
 New molecular entities and new therapeutic biological products
  D08958
New drug approvals in Europe [br08329.html]
 European public assessment reports (EPAR) authorised medicine
  D08958
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D08958
BRITE hierarchy
Other DBs
CAS: 128607-22-7
PubChem: 96025641
ChEBI: 73275
ChEMBL: CHEMBL2105395
LigandBox: D08958
LinkDB All DBs
KCF data Show

ATOM        27
            1   C8x C    12.5627  -17.6056
            2   C8x C    12.5627  -19.0081
            3   C8x C    13.7772  -19.7093
            4   C8x C    14.9918  -19.0081
            5   C8y C    14.9918  -17.6056
            6   C8x C    13.7772  -16.9044
            7   C2c C    16.2251  -16.8934
            8   C8y C    17.4323  -17.5903
            9   C8x C    17.4327  -19.0077
            10  C8x C    18.6474  -19.7086
            11  C8y C    19.8618  -19.0070
            12  C8x C    19.8613  -17.5895
            13  C8x C    18.6466  -16.8887
            14  C2c C    16.2248  -15.5021
            15  C1b C    14.9983  -14.7942
            16  C8y C    17.4273  -14.8074
            17  C8x C    18.6194  -15.4955
            18  C8x C    19.8338  -14.7941
            19  C8x C    19.8337  -13.3917
            20  C8x C    18.6416  -12.7037
            21  C8x C    17.4272  -13.4050
            22  C1b C    13.7952  -15.4893
            23  X   Cl   12.6083  -14.8043
            24  O2a O    21.0698  -19.7093
            25  C1b C    22.2844  -19.0081
            26  C1b C    23.4989  -19.7093
            27  O1a O    24.7134  -19.0081
BOND        29
            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     8   9 2
            10    9  10 1
            11   10  11 2
            12   11  12 1
            13   12  13 2
            14    8  13 1
            15    7  14 2
            16   14  15 1
            17   14  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   15  22 1
            25   22  23 1
            26   11  24 1
            27   24  25 1
            28   25  26 1
            29   26  27 1

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