KEGG   DRUG: Pamicogrel
Entry
D01090                      Drug                                   
Name
Pamicogrel (JAN/INN)
Formula
C25H24N2O4S
Exact mass
448.1457
Mol weight
448.5341
Structure
Efficacy
Platelet aggregation inhibitor, COX inhibitor
Target
PTGS1 (COX1) [HSA:5742] [KO:K00509]
PTGS2 (COX2) [HSA:5743] [KO:K11987]
Structure map
map07112  1,2-Diphenyl substitution family
Brite
Target-based classification of drugs [BR:br08310]
 Enzymes
  Oxidoreductases (EC1)
   Prostaglandin synthase
    PTGS1 (COX1)
     D01090  Pamicogrel (JAN/INN)
    PTGS2 (COX2)
     D01090  Pamicogrel (JAN/INN)
Other DBs
CAS: 101001-34-7
PubChem: 7848153
ChEBI: 31957
LigandBox: D01090
KCF data

ATOM        32
            1   C8x C    13.0200   -7.9100
            2   C8y C    13.0200   -9.3100
            3   C8x C    14.2100  -10.0100
            4   C8x C    15.4000   -9.3100
            5   C8y C    15.4000   -7.9100
            6   C8x C    14.2100   -7.2100
            7   C8y C    13.0200   -3.5000
            8   C8x C    13.0200   -4.9000
            9   C8x C    14.2100   -5.6000
            10  C8y C    15.4000   -4.9000
            11  C8x C    15.4000   -3.5000
            12  C8x C    14.2100   -2.8000
            13  C8y C    18.6900   -6.4400
            14  C8y C    20.0900   -6.4400
            15  N4y N    20.9300   -7.5600
            16  C8x C    22.2600   -7.1400
            17  C8x C    22.2600   -5.7400
            18  C8x C    20.9300   -5.3200
            19  S2x S    17.9200   -5.2500
            20  C8y C    16.5200   -5.7400
            21  C8y C    16.5200   -7.1400
            22  N5x N    17.9200   -7.5600
            23  O2a O    11.7600   -2.8000
            24  C1a C    10.5700   -3.5000
            25  O2a O    11.7600  -10.0100
            26  C1a C    10.5700   -9.3100
            27  C1b C    20.9300   -8.9600
            28  C7a C    22.1200   -9.6600
            29  O6a O    22.1200  -11.0600
            30  O7a O    23.3100   -8.9600
            31  C1b C    24.5700   -9.7300
            32  C1a C    25.7600   -9.0300
BOND        35
            1    14  15 1
            2    15  16 1
            3    16  17 2
            4    17  18 1
            5    18  14 2
            6     5   6 2
            7     7   8 2
            8     8   9 1
            9     9  10 2
            10   13  19 1
            11   19  20 1
            12   20  21 2
            13   21  22 1
            14   22  13 2
            15   20  10 1
            16   21   5 1
            17   10  11 1
            18    7  23 1
            19   11  12 2
            20   23  24 1
            21   12   7 1
            22    2  25 1
            23    6   1 1
            24   25  26 1
            25   15  27 1
            26   13  14 1
            27   27  28 1
            28    1   2 2
            29   28  29 2
            30    2   3 1
            31   28  30 1
            32    3   4 2
            33   30  31 1
            34    4   5 1
            35   31  32 1

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Ontology (1)   
   KEGG BRITE (1)   
Pathway (1)   
   KEGG PATHWAY (1)   
Drug (1)   
   LigandBox (1)   
Chemical substance (2)   
   PubChem (1)   
   ChEBI (1)   
Gene (4)   
   KEGG ORTHOLOGY (2)   
   KEGG GENES (2)   
All databases (9)   

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