KEGG   DRUG: Pimicotinib hydrochloride
Entry
D12939                      Drug                                   
Name
Pimicotinib hydrochloride (USAN);
Pimicotinib hydrochloride hydrate
Formula
C22H24N6O3. HCl. H2O
Exact mass
474.1782
Mol weight
474.94
Structure
Remark
Chemical structure group: DG03317
Efficacy
Anti-inflammatory, Antineoplastic, Macrophage colony-stimulating factor receptor antagonist
Target
CSF1R (FMS, CD115) [HSA:1436] [KO:K05090]
  Pathway
hsa04010  MAPK signaling pathway
hsa04060  Cytokine-cytokine receptor interaction
Brite
Target-based classification of drugs [BR:br08310]
 Cytokines and receptors
  Cytokine receptors
   CSF and other factor receptors
    CSF1R (FMS, CD115)
     D12939  Pimicotinib hydrochloride (USAN)
Other DBs
CAS: 2759304-23-7
PubChem: 497621352
LinkDB
KCF data

ATOM        33
            1   O2a O    19.2456  -18.4058
            2   C8y C    18.0559  -17.7060
            3   C8x C    18.0559  -16.3063
            4   C8x C    16.7962  -15.6065
            5   C8y C    15.6065  -16.3063
            6   N5x N    15.6065  -17.7060
            7   C8y C    16.7962  -18.4058
            8   N1b N    14.4167  -15.6065
            9   C5a C    14.4167  -14.2068
            10  O5a O    15.6065  -13.5069
            11  N1y N    13.2270  -13.5069
            12  C1x C    12.8071  -12.1772
            13  C1x C    11.4074  -12.1772
            14  C1z C    10.9175  -13.5069
            15  C5x C    12.0373  -14.3468
            16  C1a C    16.7962  -19.8055
            17  O5x O    12.0373  -15.7464
            18  C1a C     9.5878  -13.9268
            19  C1a C     9.9377  -12.4572
            20  C8y C    20.5054  -17.7060
            21  C8x C    20.5054  -16.3063
            22  C8x C    21.6951  -18.4058
            23  C8y C    22.9548  -17.7060
            24  N5x N    22.9548  -16.3063
            25  C8x C    21.6951  -15.6065
            26  C8y C    24.1445  -18.4058
            27  C8x C    24.5644  -19.7355
            28  N5x N    25.9641  -19.6655
            29  N4y N    26.3840  -18.3358
            30  C8x C    25.2643  -17.5660
            31  C1a C    27.6437  -17.9159
            32  X   Cl   27.5800  -12.8800
            33  O0  O    28.0700  -14.7000
BOND        34
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     6   7 2
            7     2   7 1
            8     5   8 1
            9     8   9 1
            10    9  10 2
            11    9  11 1
            12   11  12 1
            13   12  13 1
            14   13  14 1
            15   14  15 1
            16   11  15 1
            17    7  16 1
            18   15  17 2
            19   14  18 1
            20   14  19 1
            21    1  20 1
            22   21  20 2
            23   20  22 1
            24   22  23 2
            25   23  24 1
            26   24  25 2
            27   21  25 1
            28   23  26 1
            29   26  27 1
            30   27  28 2
            31   28  29 1
            32   29  30 1
            33   26  30 2
            34   29  31 1

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