KEGG   DRUG: D10060Help
Entry
D10060                      Drug                                   

Name
Abexinostat (USAN)
Formula
C21H23N3O5
Exact mass
397.1638
Mol weight
397.4244
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Antineoplastic
Target
histone deacetylases (HDACs) inhibitor [HSA:3065 3066 8841 9759 10014 10013 51564 55869 9734 83933] [KO:K06067 K11404 K11406 K11407 K11408 K11405 K11409]
  Pathway
hsa04110  Cell cycle
hsa04330  Notch signaling pathway
hsa05200  Pathways in cancer  
 
Brite
Target-based classification of drugs [BR:br08310]
 Enzymes
  Hydrolases
   histone deacetylase
    Abexinostat
     D10060  Abexinostat (USAN)
BRITE hierarchy
Other DBs
CAS: 
783355-60-2
PubChem: 
LigandBox: 
LinkDB All DBs
KCF data Show

ATOM        29
            1   C8y C    11.9700  -15.9600
            2   C5a C    13.1824  -16.6600
            3   N1b N    14.3779  -15.9696
            4   O5a O    13.1825  -18.0598
            5   C1b C    15.5653  -16.6551
            6   C1b C    16.7565  -15.9671
            7   O2a O    17.9460  -16.6538
            8   C8y C    19.1361  -15.9665
            9   C8x C    20.3262  -16.6535
            10  C8x C    21.5386  -15.9534
            11  C8y C    21.5385  -14.5534
            12  C8x C    20.3485  -13.8664
            13  C8x C    19.1361  -14.5665
            14  C5a C    22.7640  -13.8456
            15  N1b N    23.9721  -14.5429
            16  O5a O    22.7637  -12.4601
            17  O2x O    11.5442  -14.6263
            18  C8y C    10.1442  -14.6192
            19  C8y C     9.7048  -15.9484
            20  C8y C    10.8332  -16.7771
            21  C1b C    10.8256  -18.1998
            22  N1c N     9.6279  -18.8830
            23  C1a C     8.4505  -18.1950
            24  C1a C     9.6902  -20.2994
            25  C8x C     9.2128  -13.5740
            26  C8x C     7.8419  -13.8580
            27  C8x C     7.4024  -15.1873
            28  C8x C     8.3339  -16.2325
            29  O1b O    25.1530  -13.8610
BOND        31
            1     1   2 1
            2     2   3 1
            3     2   4 2
            4     3   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 1
            8     8   9 2
            9     9  10 1
            10   10  11 2
            11   11  12 1
            12   12  13 2
            13    8  13 1
            14   11  14 1
            15   14  15 1
            16   14  16 2
            17    1  17 1
            18   17  18 1
            19   18  19 2
            20   19  20 1
            21    1  20 2
            22   20  21 1
            23   21  22 1
            24   22  23 1
            25   22  24 1
            26   18  25 1
            27   25  26 2
            28   26  27 1
            29   27  28 2
            30   19  28 1
            31   15  29 1

» Japanese version   » Back

DBGET integrated database retrieval system