KEGG   DRUG: Seladelpar
Entry
D11256                      Drug                                   
Name
Seladelpar (USAN/INN)
Formula
C21H23F3O5S
Exact mass
444.1218
Mol weight
444.47
Structure
Remark
ATC code: A05AX07
Chemical structure group: DG02957
Product (DG02957): D11257<US>
Efficacy
Anti-inflammatory, Peroxisome proliferator-activated receptor (PPAR) delta agonist
Comment
Treatment of homozygous familial hypercholesterolemia (HoFH)
Target
NR1C3 (PPARG) [HSA:5468] [KO:K08530]
  Pathway
hsa03320  PPAR signaling pathway
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 A ALIMENTARY TRACT AND METABOLISM
  A05 BILE AND LIVER THERAPY
   A05A BILE THERAPY
    A05AX Other drugs for bile therapy
     A05AX07 Seladelpar
      D11256  Seladelpar (USAN/INN)
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Thyroid hormone like receptors
   Peroxisome proliferator-activated receptor (PPAR)
    NR1C3 (PPARG)
     D11256  Seladelpar (USAN/INN)
Other DBs
CAS: 851528-79-5
PubChem: 384585234
PDB-CCD: KKB[PDBj]
LinkDB
KCF data

ATOM        30
            1   C8x C    10.3600  -14.5600
            2   C8y C    10.3600  -15.9600
            3   C8x C    11.5724  -16.6600
            4   C8x C    12.7849  -15.9600
            5   C8y C    12.7849  -14.5600
            6   C8x C    11.5724  -13.8600
            7   O2a O    14.0160  -13.8490
            8   C1b C    15.2212  -14.5447
            9   C1c C    16.4035  -13.8619
            10  C1b C    17.5975  -14.5512
            11  S2a S    18.7854  -13.8652
            12  C8y C    19.9765  -14.5529
            13  C8x C    19.9766  -15.9597
            14  C8y C    21.1891  -16.6597
            15  C8y C    22.4015  -15.9596
            16  C8x C    22.4014  -14.5527
            17  C8x C    21.1889  -13.8528
            18  C1a C    21.1892  -18.0598
            19  O2a O    23.6130  -16.6590
            20  C1b C    24.8076  -15.9690
            21  C6a C    25.9955  -16.6547
            22  O6a O    27.1864  -15.9668
            23  O6a O    25.9958  -18.0598
            24  C1d C     9.1476  -16.6600
            25  X   F     7.9351  -17.3600
            26  X   F     8.4476  -15.4476
            27  X   F     9.8476  -17.8724
            28  O2a O    16.4035  -12.4602
            29  C1b C    17.5983  -11.7702
            30  C1a C    17.5984  -10.3603
BOND        31
            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 1
            10    9  10 1
            11   10  11 1
            12   11  12 1
            13   12  13 2
            14   13  14 1
            15   14  15 2
            16   15  16 1
            17   16  17 2
            18   12  17 1
            19   14  18 1
            20   15  19 1
            21   19  20 1
            22   20  21 1
            23   21  22 1
            24   21  23 2
            25    2  24 1
            26   24  25 1
            27   24  26 1
            28   24  27 1
            29    9  28 1 #Up
            30   28  29 1
            31   29  30 1

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