KEGG   DRUG: Procaine hydrochloride
Entry
D00740                      Drug                                   
Name
Procaine hydrochloride (JP18/USP);
Novocain (TN)
Formula
C13H20N2O2. HCl
Exact mass
272.1292
Mol weight
272.77
Structure
Simcomp
Class
Neuropsychiatric agent
 DG02030  Anesthetics
  DG01675  Local anesthetic
   DG01674  Esterified local anesthetic
Remark
Same as: C07894
Therapeutic category: 1211
ATC code: C05AD05 N01BA02 S01HA05
Chemical structure group: DG00298
Product (DG00298): D00740<JP>
Efficacy
Anesthetic (local)
Comment
Ester-type
Target
SCN1A [HSA:6323] [KO:K04833]
SCN2A [HSA:6326] [KO:K04834]
SCN3A [HSA:6328] [KO:K04836]
SCN4A [HSA:6329] [KO:K04837]
SCN5A [HSA:6331] [KO:K04838]
SCN8A [HSA:6334] [KO:K04840]
SCN9A [HSA:6335] [KO:K04841]
SCN10A [HSA:6336] [KO:K04842]
SCN11A [HSA:11280] [KO:K04843]
  Pathway
hsa04728  Dopaminergic synapse
Interaction
Structure map
map07015  Local analgesics
map07037  Antiarrhythmic drugs
map07110  Benzoic acid family
map07231  Sodium channel blocking drugs
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 C CARDIOVASCULAR SYSTEM
  C05 VASOPROTECTIVES
   C05A AGENTS FOR TREATMENT OF HEMORRHOIDS AND ANAL FISSURES FOR TOPICAL USE
    C05AD Local anesthetics
     C05AD05 Procaine
      D00740  Procaine hydrochloride (JP18/USP) <JP>
 N NERVOUS SYSTEM
  N01 ANESTHETICS
   N01B ANESTHETICS, LOCAL
    N01BA Esters of aminobenzoic acid
     N01BA02 Procaine
      D00740  Procaine hydrochloride (JP18/USP) <JP>
 S SENSORY ORGANS
  S01 OPHTHALMOLOGICALS
   S01H LOCAL ANESTHETICS
    S01HA Local anesthetics
     S01HA05 Procaine
      D00740  Procaine hydrochloride (JP18/USP) <JP>
Therapeutic category of drugs in Japan [BR:br08301]
 1  Agents affecting nervous system and sensory organs
  12  Agents affecting peripheral nervous system
   121  Local anesthetics
    1211  Aminobenzoate alkamine esters
     D00740  Procaine hydrochloride (JP18/USP)
Classification of Japanese OTC drugs [BR:br08313]
 Agents for  urogenital organs and anus
  30 Hemorrhoid drugs for external use
   D00740  Procaine hydrochloride (JP18/USP)
Risk category of Japanese OTC drugs [BR:br08312]
 Second-class OTC drugs
  Inorganic and organic chemicals
   Procaine
    D00740  Procaine hydrochloride (JP18/USP)
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG02030  Anesthetics
   DG01675  Local anesthetic
    DG01674  Esterified local anesthetic
     DG00298  Procaine
      D00740  Procaine hydrochloride
Target-based classification of drugs [BR:br08310]
 Ion channels
  Voltage-gated ion channels
   Sodium channels
    SCN1A
     D00740  Procaine hydrochloride (JP18/USP) <JP>
    SCN2A
     D00740  Procaine hydrochloride (JP18/USP) <JP>
    SCN3A
     D00740  Procaine hydrochloride (JP18/USP) <JP>
    SCN4A
     D00740  Procaine hydrochloride (JP18/USP) <JP>
    SCN5A
     D00740  Procaine hydrochloride (JP18/USP) <JP>
    SCN8A
     D00740  Procaine hydrochloride (JP18/USP) <JP>
    SCN9A
     D00740  Procaine hydrochloride (JP18/USP) <JP>
    SCN10A
     D00740  Procaine hydrochloride (JP18/USP) <JP>
    SCN11A
     D00740  Procaine hydrochloride (JP18/USP) <JP>
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00740  Procaine hydrochloride
  D00740  Procaine hydrochloride injection
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG02030  Anesthetics
   DG01675  Local anesthetic
    DG01674  Esterified local anesthetic
     DG00298  Procaine
Other DBs
CAS: 51-05-8
PubChem: 7847805
ChEBI: 8431
LigandBox: D00740
NIKKAJI: J99.319K
LinkDB
KCF data

ATOM        18
            1   C8y C    19.4210  -17.9429
            2   C7a C    20.6303  -18.6322
            3   C8x C    19.4210  -16.5350
            4   C8x C    18.2117  -18.6380
            5   O7a O    21.8454  -17.9369
            6   O6a O    20.6244  -20.0401
            7   C8x C    18.2117  -15.8340
            8   C8x C    16.9967  -17.9429
            9   C1b C    23.0606  -18.6263
            10  C8y C    16.9967  -16.5350
            11  C1b C    24.2757  -17.9254
            12  N1a N    15.7757  -15.8397
            13  N1c N    25.4909  -18.6205
            14  C1b C    26.6942  -17.9195
            15  C1b C    25.4909  -20.0167
            16  C1a C    27.9093  -18.6146
            17  C1a C    26.6942  -20.7237
            18  X   Cl   30.4040  -20.5309
BOND        17
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 1
            5     2   6 2
            6     3   7 2
            7     4   8 1
            8     5   9 1
            9     7  10 1
            10    9  11 1
            11   10  12 1
            12   11  13 1
            13   13  14 1
            14   13  15 1
            15   14  16 1
            16   15  17 1
            17    8  10 2

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KEGG   DRUG: Penicillin G procaine
Entry
D02461                      Drug                                   
Name
Penicillin G procaine (USP);
Duracillin (TN)
Formula
C16H18N2O4S. C13H20N2O2. H2O
Exact mass
588.2618
Mol weight
588.72
Structure
Class
Antibacterial
 DG01710  beta-Lactam antibiotic
  DG01713  Penicillin skeleton group
   DG01480  Penicillin
 DG01778  beta-Lactamase sensitive penicillin
Remark
ATC code: J01CE01 S01AA14
Chemical structure group: DG00534
Product (DG00534): D01053<JP/US> D02157<JP/US> D05408<US>
Product (mixture): D12297<US>
Efficacy
Antibacterial, Cell wall biosynthesis inhibitor
  Disease
Scarlet fever [DS:H01515]
Erysipelas [DS:H01517]
Vincent's gingivitis [DS:H01440]
Syphilis [DS:H00354]
Yaws [DS:H01318]
Bejel [DS:H01531]
Pinta [DS:H01530]
Diphtheria [DS:H00343]
Anthrax [DS:H00328]
Rat-bite fever [DS:H01314]
Erysipeloid [DS:H01315]
Bacterial endocarditis [DS:H00334]
Target
penicillin binding protein
  Pathway
ko00550  Peptidoglycan biosynthesis
Interaction
Structure map
map07110  Benzoic acid family
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 J ANTIINFECTIVES FOR SYSTEMIC USE
  J01 ANTIBACTERIALS FOR SYSTEMIC USE
   J01C BETA-LACTAM ANTIBACTERIALS, PENICILLINS
    J01CE Beta-lactamase sensitive penicillins
     J01CE01 Benzylpenicillin
      D02461  Penicillin G procaine (USP)
 S SENSORY ORGANS
  S01 OPHTHALMOLOGICALS
   S01A ANTIINFECTIVES
    S01AA Antibiotics
     S01AA14 Benzylpenicillin
      D02461  Penicillin G procaine (USP)
USP drug classification [BR:br08302]
 Antibacterials
  Beta-lactam, Penicillins
   Penicillin G
    D02461  Penicillin G procaine (USP)
Drug groups [BR:br08330]
 Antibacterial
  DG01710  beta-Lactam antibiotic
   DG01713  Penicillin skeleton group
    DG01480  Penicillin
     DG00534  Benzylpenicillin
      D02461  Penicillin G procaine
  DG01778  beta-Lactamase sensitive penicillin
   DG00534  Benzylpenicillin
    D02461  Penicillin G procaine
Antimicrobials [BR:br08307]
 Antibacterials
  Cell wall biosynthesis inhibitor, beta-lactam
   beta-Lactamase sensitive penicillin
    D02461  Penicillin G procaine (USP)
Drug groups [BR:br08330]
 Antibacterial
  DG01710  beta-Lactam antibiotic
   DG01713  Penicillin skeleton group
    DG01480  Penicillin
     DG00534  Benzylpenicillin
  DG01778  beta-Lactamase sensitive penicillin
   DG00534  Benzylpenicillin
Antimicrobials abbreviations [BR:br08327]
 Antibacterials
  Cell wall biosynthesis inhibitor, beta-lactam
   beta-Lactamase sensitive penicillin
    DG00534  Benzylpenicillin
Other DBs
CAS: 6130-64-9
PubChem: 7849517
LigandBox: D02461
NIKKAJI: J1.590.667G
LinkDB
KCF data

ATOM        41
            1   C8y C    35.5036  -15.3484
            2   C7a C    36.7166  -16.0481
            3   C8x C    35.5036  -13.9488
            4   C8x C    34.2907  -16.0481
            5   O7a O    37.9295  -15.3484
            6   O6a O    36.7166  -17.4476
            7   C8x C    34.2907  -13.2491
            8   C8x C    33.0777  -15.3484
            9   C1b C    39.1425  -16.0481
            10  C8y C    33.0777  -13.9488
            11  C1b C    40.3555  -15.3484
            12  N1a N    31.8648  -13.2491
            13  N1c N    41.5684  -16.0481
            14  C1b C    42.7812  -15.3018
            15  C1b C    41.5684  -17.4010
            16  C1a C    43.9943  -16.0016
            17  C1a C    42.7812  -18.1474
            18  O0  O    39.8651  -19.5004
            19  C1y C    25.9481  -15.6412
            20  C5x C    25.9481  -17.0459
            21  N1y N    27.3529  -17.0459
            22  C1y C    27.3529  -15.6412
            23  C1y C    28.6873  -17.4673
            24  C1z C    29.5300  -16.3435
            25  S2x S    28.6873  -15.2197
            26  C1a C    30.5134  -17.3268
            27  C1a C    30.5134  -15.3602
            28  C6a C    29.1789  -18.8017
            29  O6a O    30.5835  -18.8017
            30  O6a O    28.3360  -19.9254
            31  N1b N    24.7541  -14.9388
            32  C5a C    23.5602  -15.6412
            33  O5x O    24.7541  -17.7482
            34  O5a O    23.5602  -17.0459
            35  C1b C    22.3408  -14.9437
            36  C8y C    21.1485  -15.6389
            37  C8x C    19.9350  -14.9383
            38  C8x C    18.7216  -15.6389
            39  C8x C    18.7216  -17.0400
            40  C8x C    19.9350  -17.7406
            41  C8x C    21.1485  -17.0400
BOND        42
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 1
            5     2   6 2
            6     3   7 2
            7     4   8 1
            8     5   9 1
            9     7  10 1
            10    9  11 1
            11   10  12 1
            12   11  13 1
            13   13  14 1
            14   13  15 1
            15   14  16 1
            16   15  17 1
            17    8  10 2
            18   19  20 1
            19   20  21 1
            20   21  22 1
            21   19  22 1
            22   21  23 1
            23   23  24 1
            24   24  25 1
            25   22  25 1
            26   24  26 1
            27   24  27 1
            28   23  28 1 #Down
            29   28  29 1
            30   28  30 2
            31   19  31 1 #Up
            32   31  32 1
            33   20  33 2
            34   32  34 2
            35   32  35 1
            36   35  36 1
            37   36  37 2
            38   37  38 1
            39   38  39 2
            40   39  40 1
            41   40  41 2
            42   36  41 1

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