KEGG   DRUG: Tanaproget
Entry
D06003                      Drug                                   
Name
Tanaproget (USAN/INN)
Formula
C16H15N3OS
Exact mass
297.0936
Mol weight
297.38
Structure
Efficacy
Contraceptive (oral), Progesterone receptor agonist
Target
NR3C3 (PGR) [HSA:5241] [KO:K08556]
  Pathway
hsa04114  Oocyte meiosis
hsa04914  Progesterone-mediated oocyte maturation
hsa04915  Estrogen signaling pathway
Brite
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   3-Ketosteroid receptor
    NR3C3 (PGR)
     D06003  Tanaproget (USAN/INN)
Other DBs
CAS: 304853-42-7
PubChem: 47207661
PDB-CCD: T98[PDBj]
LigandBox: D06003
LinkDB
KCF data

ATOM        21
            1   C8x C    32.1154  -15.5971
            2   C8y C    32.1154  -17.0025
            3   C8x C    33.3326  -17.7052
            4   C8y C    34.5498  -17.0025
            5   C8y C    34.5498  -15.5971
            6   C8x C    33.3326  -14.8944
            7   C1z C    35.7669  -17.7052
            8   O2x O    36.9840  -17.0025
            9   C2y C    36.9840  -15.5971
            10  N1x N    35.7669  -14.8944
            11  S0  S    38.1862  -14.9029
            12  C1a C    34.7731  -18.6990
            13  C1a C    36.7607  -18.6990
            14  C8y C    30.8983  -17.7052
            15  N4y N    29.7743  -16.9026
            16  C8y C    28.6581  -17.7221
            17  C8x C    29.0924  -19.0370
            18  C8x C    30.4772  -19.0302
            19  C1a C    29.7676  -15.5033
            20  C3b C    27.2955  -17.2868
            21  N3a N    25.9432  -16.9244
BOND        23
            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     4   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    5  10 1
            12    9  11 2
            13    7  12 1
            14    7  13 1
            15    2  14 1
            16   14  15 1
            17   15  16 1
            18   16  17 2
            19   17  18 1
            20   14  18 2
            21   15  19 1
            22   16  20 1
            23   20  21 3

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