KEGG   DRUG: D10102Help
Entry
D10102                      Drug                                   

Name
Crenolanib (USAN)
Formula
C26H29N5O2
Exact mass
443.2321
Mol weight
443.5408
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Antineoplastic
Remark
Drug group: 
Comment
angiogenesis inhibitor
Target
PDGFR tyrosine kinase inhibitor [HSA:5156 5159] [KO:K04363 K05089]
  Pathway
hsa04010  MAPK signaling pathway
hsa04020  Calcium signaling pathway
hsa04060  Cytokine-cytokine receptor interaction
hsa05200  Pathways in cancer  
 
Brite
Target-based classification of drugs [BR:br08310]
 Cytokine receptors
  Receptor tyrosine kinase
   RTK class III (PDGF receptor family)
    PDGFRA tyrosine kinase
     Crenolanib
      D10102  Crenolanib (USAN)
    PDGFRB tyrosine kinase
     Crenolanib
      D10102  Crenolanib (USAN)
BRITE hierarchy
Other DBs
CAS: 
670220-88-9
PubChem: 
LigandBox: 
KCF data Show

ATOM        33
            1   C8y C    19.3200  -18.6900
            2   C8y C    19.3200  -20.0900
            3   C8y C    20.5324  -20.7900
            4   C8x C    21.7449  -20.0900
            5   C8x C    21.7449  -18.6900
            6   C8x C    20.5324  -17.9900
            7   C8x C    18.1076  -17.9900
            8   C8x C    16.8951  -18.6900
            9   C8y C    16.8951  -20.0900
            10  N5x N    18.1076  -20.7900
            11  N1y N    20.5324  -22.1898
            12  C1x C    19.3032  -22.8997
            13  C1x C    19.3034  -24.2997
            14  C1y C    20.5159  -24.9996
            15  C1x C    21.7451  -24.2897
            16  C1x C    21.7449  -22.8897
            17  N1a N    20.5160  -26.3900
            18  N4y N    15.6640  -20.8010
            19  C8y C    14.3944  -20.2358
            20  C8y C    13.4645  -21.2687
            21  N5x N    14.1594  -22.4722
            22  C8x C    15.5188  -22.1832
            23  C8x C    13.9617  -18.9044
            24  C8x C    12.5922  -18.6134
            25  C8y C    11.6623  -19.6462
            26  C8x C    12.0950  -20.9777
            27  O2a O    10.3242  -19.3623
            28  C1b C     9.3589  -20.4355
            29  C1z C     8.0105  -20.4296
            30  C1x C     7.0154  -19.4253
            31  O2x O     6.0112  -20.4204
            32  C1x C     7.0062  -21.4246
            33  C1a C     8.5395  -21.7233
BOND        38
            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     1   7 1
            8     7   8 2
            9     8   9 1
            10    9  10 2
            11    2  10 1
            12    3  11 1
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16   14  15 1
            17   15  16 1
            18   11  16 1
            19   14  17 1
            20    9  18 1
            21   18  19 1
            22   19  20 1
            23   20  21 1
            24   21  22 2
            25   18  22 1
            26   19  23 2
            27   23  24 1
            28   24  25 2
            29   25  26 1
            30   20  26 2
            31   25  27 1
            32   27  28 1
            33   28  29 1
            34   29  30 1
            35   30  31 1
            36   31  32 1
            37   29  32 1
            38   29  33 1

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