KEGG   DRUG: TrimethoprimHelp
Entry
D00145                      Drug                                   

Name
Trimethoprim (JAN/USP/INN);
Proloprim (TN);
Trimpex (TN)
Product
  Generic
Formula
C14H18N4O3
Exact mass
290.1379
Mol weight
290.3177
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Antibacterial
 DG01581  Trimethoprim antibacterial
 DG01931  Dihydrofolate reductase inhibitor, antibacterial
Enzyme inhibitor
 DG01641  CYP2C8 inhibitor
Remark
Same as: C01965
ATC code: J01EA01
Chemical structure group: DG00595
Product (DG00595): D00145<US> D11085<US>
Product (mixture): D00285<JP/US> D11086<US>
Efficacy
Antibacterial, Folic acid biosynthesis inhibitor
  Disease
Uncomplicated urinary tract infections [DS:H01176]
Target
dihydrofolate reductase [KO:K13938]
  Pathway
ko00670  One carbon pool by folate
ko00790  Folate biosynthesis
Interaction
CYP inhibition: CYP2C8 [HSA:1558]
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 J ANTIINFECTIVES FOR SYSTEMIC USE
  J01 ANTIBACTERIALS FOR SYSTEMIC USE
   J01E SULFONAMIDES AND TRIMETHOPRIM
    J01EA Trimethoprim and derivatives
     J01EA01 Trimethoprim
      D00145  Trimethoprim (JAN/USP/INN) <US>
USP drug classification [BR:br08302]
 Antibacterials
  Antibacterials, Other
   Trimethoprim
    D00145  Trimethoprim (JAN/USP/INN)
Antiinfectives [br08350.html]
 Antibacterials
  D00145
BRITE hierarchy
Other DBs
CAS: 738-70-5
PubChem: 7847213
ChEBI: 45924
ChEMBL: CHEMBL22
DrugBank: DB00440
PDB-CCD: TOP[PDBj] TRR[PDBj]
LigandBox: D00145
NIKKAJI: J9.454D
LinkDB All DBs
KCF data Show

ATOM        21
            1   C8y C    15.9128  -15.6038
            2   C1b C    17.1236  -16.2959
            3   C8x C    14.6954  -16.3150
            4   C8x C    15.9128  -14.1943
            5   C8y C    18.3218  -15.5974
            6   C8y C    13.4846  -15.6038
            7   C8y C    14.6954  -13.4961
            8   C8y C    19.5327  -16.3085
            9   C8x C    18.3218  -14.1880
            10  C8y C    13.4846  -14.1943
            11  O2a O    12.2737  -16.2959
            12  O2a O    14.6891  -12.1057
            13  N5x N    20.7563  -15.5974
            14  N1a N    19.5262  -17.6988
            15  N5x N    19.5327  -13.4896
            16  O2a O    12.2800  -13.5661
            17  C1a C    11.0757  -15.5909
            18  C1a C    15.8936  -11.4010
            19  C8y C    20.7563  -14.1880
            20  C1a C    12.2800  -12.1057
            21  N1a N    21.9609  -13.4833
BOND        22
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 1
            5     3   6 2
            6     4   7 1
            7     5   8 2
            8     5   9 1
            9     6  10 1
            10    6  11 1
            11    7  12 1
            12    8  13 1
            13    8  14 1
            14    9  15 2
            15   10  16 1
            16   11  17 1
            17   12  18 1
            18   13  19 2
            19   16  20 1
            20   19  21 1
            21    7  10 2
            22   15  19 1

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