KEGG   DRUG: Delanzomib
Entry
D10110                      Drug                                   
Name
Delanzomib (USAN)
Formula
C21H28BN3O5
Exact mass
413.2122
Mol weight
413.2751
Structure
Class
Antineoplastic
 DG03134  Proteasome inhibitor
Efficacy
Antineoplastic, Proteasome inhibitor
Comment
Treatment of multiple myeloma, mantel cell lymphoma
Target
PSMB1 [HSA:5689] [KO:K02732]
PSMB5 [HSA:5693] [KO:K02737]
  Pathway
hsa03050  Proteasome
Brite
Drug groups [BR:br08330]
 Antineoplastic
  DG03134  Proteasome inhibitor
   D10110  Delanzomib
Target-based classification of drugs [BR:br08310]
 Enzymes
  Hydrolases (EC3)
   Threonine peptidases
    PSMB1
     D10110  Delanzomib (USAN)
    PSMB5
     D10110  Delanzomib (USAN)
Other DBs
CAS: 847499-27-8
PubChem: 135626828
ChEBI: 141530
LinkDB
KCF data

ATOM        30
            1   C8y C    13.8491  -16.5169
            2   C8x C    13.8491  -17.9221
            3   C8x C    15.0660  -18.6247
            4   C8x C    16.2830  -17.9221
            5   C8y C    16.2830  -16.5169
            6   N5x N    15.0660  -15.8143
            7   C8y C    12.6321  -15.8143
            8   C8x C    12.6321  -14.4093
            9   C8x C    11.4151  -13.7067
            10  C8x C    10.1982  -14.4093
            11  C8x C    10.1982  -15.8143
            12  C8x C    11.4151  -16.5169
            13  C5a C    17.5187  -15.8032
            14  N1b N    18.7284  -16.5015
            15  O5a O    17.5184  -14.4092
            16  C1c C    19.9151  -15.8162
            17  C5a C    21.1136  -16.5081
            18  N1b N    22.3059  -15.8195
            19  O5a O    21.1138  -17.9218
            20  C1c C    19.9151  -14.4093
            21  O1a O    18.6805  -13.6963
            22  C1a C    21.1144  -13.7167
            23  C1c C    23.5015  -16.5098
            24  C1b C    24.6953  -15.8204
            25  Z   B    23.5017  -17.9218
            26  O1a O    24.6985  -18.6130
            27  O1a O    22.2647  -18.6364
            28  C1c C    25.8901  -16.5103
            29  C1a C    27.0844  -15.8206
            30  C1a C    25.8903  -17.9219
BOND        31
            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   10  11 1
            12   11  12 2
            13    7  12 1
            14    5  13 1
            15   13  14 1
            16   13  15 2
            17   16  14 1 #Up
            18   16  17 1
            19   17  18 1
            20   17  19 2
            21   16  20 1
            22   20  21 1 #Down
            23   20  22 1
            24   18  23 1
            25   23  24 1
            26   23  25 1 #Up
            27   25  26 1
            28   25  27 1
            29   24  28 1
            30   28  29 1
            31   28  30 1

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