KEGG   DRUG: D01029Help
Entry
D01029                      Drug                                   

Name
Tirofiban hydrochloride (USAN);
Tirofiban hydrochloride hydrate;
Aggrastat (TN)
Product
Formula
C22H36N2O5S. HCl. H2O
Exact mass
494.2217
Mol weight
495.0729
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Treatment of unstable angina
Remark
ATC code: 
Drug group: 
Comment
Indication: Acute coronary syndrome
Target
glycoprotein alphaIIb/beta3 (GPIIb/IIIa) receptor antagonist [HSA:3674 3690] [KO:K06476 K06493]
  Pathway
hsa04510  Focal adhesion
hsa04512  ECM-receptor interaction  
 
Interaction
Drug interaction
Structure map
Antithrombosis agents
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 B BLOOD AND BLOOD FORMING ORGANS
  B01 ANTITHROMBOTIC AGENTS
   B01A ANTITHROMBOTIC AGENTS
    B01AC Platelet aggregation inhibitors excl. heparin
     B01AC17 Tirofiban
      D01029  Tirofiban hydrochloride (USAN)
Target-based classification of drugs [BR:br08310]
 Others
  Cell adhesion molecules (CAMs)
   glycoprotein alpha IIb/beta3 (GPIIb/IIIa) receptor
    Tirofiban
     D01029  Tirofiban hydrochloride (USAN)
BRITE hierarchy
Other DBs
CAS: 
150915-40-5
PubChem: 
DrugBank: 
LigandBox: 
KCF data Show

ATOM        32
            1   C8y C    20.3341  -17.4804
            2   C1b C    19.1266  -16.7827
            3   C8x C    20.3273  -18.8690
            4   C8x C    21.5348  -16.7759
            5   C1c C    17.9257  -17.4804
            6   C8x C    21.5348  -19.5666
            7   C8x C    22.7357  -17.4737
            8   N1b N    17.9257  -18.8690
            9   C6a C    16.7116  -16.7827
            10  C8y C    22.7357  -18.8690
            11  S4a S    16.7853  -19.6405
            12  O6a O    15.5041  -17.4804
            13  O6a O    16.7116  -15.3873
            14  O2a O    23.9430  -19.5666
            15  C1b C    15.5041  -18.8690
            16  O3c O    17.9794  -20.5125
            17  O3c O    15.6517  -20.5058
            18  C1b C    25.1573  -18.8690
            19  C1b C    14.3034  -19.5734
            20  C1b C    26.3580  -19.5666
            21  C1b C    13.0960  -18.8690
            22  C1b C    27.5655  -18.8690
            23  C1a C    11.8884  -19.5734
            24  C1b C    28.7731  -19.5666
            25  C1y C    29.9738  -18.8690
            26  C1x C    31.1746  -19.5666
            27  C1x C    29.9671  -17.4737
            28  C1x C    32.3821  -18.8690
            29  C1x C    31.1746  -16.7759
            30  N1x N    32.3821  -17.4737
            31  X   Cl   28.6047  -21.4468
            32  O0  O    32.4098  -21.3266
BOND        31
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     3   6 1
            6     4   7 2
            7     5   8 1 #Down
            8     5   9 1
            9     6  10 2
            10    8  11 1
            11    9  12 1
            12    9  13 2
            13   10  14 1
            14   11  15 1
            15   11  16 2
            16   11  17 2
            17   14  18 1
            18   15  19 1
            19   18  20 1
            20   19  21 1
            21   20  22 1
            22   21  23 1
            23   22  24 1
            24   24  25 1
            25   25  26 1
            26   25  27 1
            27   26  28 1
            28   27  29 1
            29   28  30 1
            30    7  10 1
            31   29  30 1

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