KEGG   DRUG: Tirbanibulin
Entry
D11691                      Drug                                   

Name
Tirbanibulin (USAN/INN);
Klisyri (TN)
Product
Formula
C26H29N3O3
Exact mass
431.2209
Mol weight
431.5268
Structure
Remark
ATC code: D06BX03
Chemical structure group: DG03082
Product (DG03082): D11691<US>
Efficacy
Antineoplastic, Tubulin polymerization inhibitor, Tyrosine kinase inhibitor
  Disease
Actinic keratosis [DS:H02429]
Target
  Pathway
hsa04540  Gap junction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 D DERMATOLOGICALS
  D06 ANTIBIOTICS AND CHEMOTHERAPEUTICS FOR DERMATOLOGICAL USE
   D06B CHEMOTHERAPEUTICS FOR TOPICAL USE
    D06BX Other chemotherapeutics
     D06BX03 Tirbanibulin
      D11691  Tirbanibulin (USAN/INN) <US>
Target-based classification of drugs [BR:br08310]
 Protein kinases
  Non-receptor tyrosine kinases
   SRC family
    SRC
     D11691  Tirbanibulin (USAN/INN) <US>
 Not elsewhere classified
  Cellular process
   Cytoskeleton
    TUBB
     D11691  Tirbanibulin (USAN/INN) <US>
New drug approvals in the USA [br08319.html]
 New molecular entities and new therapeutic biological products
  D11691
New drug approvals in Europe [br08329.html]
 European public assessment reports (EPAR) authorised medicine
  D11691
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D11691
Other DBs
CAS: 897016-82-9
PubChem: 405226557
ChEMBL: CHEMBL571546
PDB-CCD: DN0[PDBj]
LinkDB
KCF data

ATOM        32
            1   O2x O    25.2700  -16.3800
            2   C1x C    25.2700  -17.7800
            3   C1x C    24.0800  -18.4800
            4   N1y N    22.8200  -17.7800
            5   C1x C    22.8200  -16.3800
            6   C1x C    24.0800  -15.6800
            7   C1b C    21.6300  -18.4800
            8   C1b C    20.4400  -17.7800
            9   O2a O    19.2500  -18.4800
            10  C8y C    18.0600  -17.7800
            11  C8x C    16.8700  -18.4800
            12  C8x C    15.6100  -17.7800
            13  C8y C    15.6100  -16.3800
            14  C8x C    16.8000  -15.6800
            15  C8x C    18.0600  -16.3800
            16  C8y C    14.4200  -15.6800
            17  C8x C    13.2300  -16.3800
            18  C8x C    11.9700  -15.6800
            19  C8y C    11.9700  -14.2800
            20  N5x N    13.1600  -13.5800
            21  C8x C    14.4200  -14.2800
            22  C1b C    10.7800  -13.5800
            23  C5a C     9.5900  -14.2800
            24  N1b N     8.4000  -13.5800
            25  O5a O     9.5900  -15.6800
            26  C1b C     7.2100  -14.2800
            27  C8y C     6.0200  -13.5800
            28  C8x C     4.8300  -14.2800
            29  C8x C     3.5700  -13.5800
            30  C8x C     3.5700  -12.1800
            31  C8x C     4.7600  -11.4800
            32  C8x C     6.0200  -12.1800
BOND        35
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11   10  11 2
            12   11  12 1
            13   12  13 2
            14   13  14 1
            15   14  15 2
            16   10  15 1
            17   13  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   19  22 1
            25   22  23 1
            26   23  24 1
            27   23  25 2
            28   24  26 1
            29   26  27 1
            30   27  28 2
            31   28  29 1
            32   29  30 2
            33   30  31 1
            34   31  32 2
            35   27  32 1

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