KEGG   DRUG: D08004Help
Entry
D08004                      Drug                                   

Name
Gabexate (INN)
Formula
C16H23N3O4
Exact mass
321.1689
Mol weight
321.3715
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Enzyme inhibitor, protease
Target
plasma kallikrein inhibitor [HSA:3818] [KO:K01324];
tissue kallikrein inhibitor [HSA:3816 3817] [KO:K01325]
  Pathway
hsa04610  Complement and coagulation cascades  
 
Interaction
Drug interaction
Structure map
Antithrombosis agents
Brite
Target-based classification of drugs [BR:br08310]
 Enzymes
  Hydrolases
   plasma kallikrein [HSA:3818] [KO:K01324]
    Gabexate
     D08004  Gabexate (INN)
   tissue kallikrein [HSA:3816 3817] [KO:K01325]
    Gabexate
     D08004  Gabexate (INN)
BRITE hierarchy
Other DBs
CAS: 
39492-01-8
PubChem: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        23
            1   C8y C    21.7700  -18.0600
            2   O7a O    22.9600  -18.7600
            3   C7a C    24.1500  -18.0600
            4   C1b C    25.3400  -18.7600
            5   C1b C    26.6000  -18.0600
            6   C1b C    27.7900  -18.7600
            7   C1b C    28.9800  -18.0600
            8   C1b C    30.2400  -18.7600
            9   N1b N    31.4300  -18.0600
            10  C2c C    32.6200  -18.7600
            11  N1a N    33.8800  -18.0600
            12  N2a N    32.6200  -20.1600
            13  O6a O    24.1500  -16.6600
            14  C8x C    21.7700  -16.6600
            15  C8x C    20.5100  -15.9600
            16  C8y C    19.3200  -16.6600
            17  C8x C    19.3200  -18.0600
            18  C8x C    20.5100  -18.7600
            19  C7a C    18.1300  -15.9600
            20  O7a O    16.8700  -16.6600
            21  C1b C    15.6800  -15.9600
            22  C1a C    14.4900  -16.6600
            23  O6a O    18.1300  -14.5600
BOND        23
            1     6   7 1
            2     7   8 1
            3     3   4 1
            4     1  14 2
            5    14  15 1
            6    15  16 2
            7    16  17 1
            8    17  18 2
            9    18   1 1
            10    8   9 1
            11   16  19 1
            12    1   2 1
            13   19  20 1
            14    9  10 1
            15   20  21 1
            16    4   5 1
            17   21  22 1
            18   10  11 1
            19   19  23 2
            20   10  12 2
            21    5   6 1
            22    3  13 2
            23    2   3 1

» Japanese version   » Back

DBGET integrated database retrieval system