KEGG   DRUG: Venglustat
Entry
D11633                      Drug                                   

Name
Venglustat (USAN/INN)
Formula
C20H24FN3O2S
Exact mass
389.1573
Mol weight
389.4869
Structure
Remark
Chemical structure group: DG03067
Efficacy
Glucosylceramide synthase inhibitor
Comment
Treatment of Fabry disease (FD), Gaucher disease type 3 (GD3), Glucocerebrosidase gene-associated Parkinson disease (GBA-PD) and Autosomal dominant polycystic kidney disease (ADPKD)
Target
UGCG [HSA:7357] [KO:K00720]
  Pathway
hsa00600  Sphingolipid metabolism
Brite
Target-based classification of drugs [BR:br08310]
 Enzymes
  Transferases (EC2)
   Hexosyltransferases
    UGCG
     D11633  Venglustat (USAN/INN)
Other DBs
CAS: 1401090-53-6
PubChem: 405226500
ChEMBL: CHEMBL4297611
LinkDB
KCF data

ATOM        27
            1   C1x C    22.7500  -17.5700
            2   C1x C    22.7500  -16.1700
            3   C1y C    21.5600  -15.4700
            4   C1y C    20.3000  -16.1700
            5   C1x C    20.3000  -17.5700
            6   N1y N    21.5600  -18.2700
            7   O7a O    19.1100  -15.4700
            8   C7a C    17.9200  -16.1700
            9   N1b N    16.7300  -15.4700
            10  O6a O    17.9200  -17.5700
            11  C1d C    15.5400  -16.1700
            12  C8y C    14.3500  -15.4700
            13  C1a C    14.8400  -17.3600
            14  C1a C    16.2400  -17.3600
            15  C8x C    13.8600  -14.1400
            16  S2x S    12.4600  -14.1400
            17  C8y C    12.0400  -15.4700
            18  N5x N    13.2300  -16.3100
            19  C8y C    10.8500  -16.1700
            20  C8x C     9.6600  -15.4700
            21  C8x C     8.4000  -16.1700
            22  C8y C     8.4000  -17.5700
            23  C8x C     9.5900  -18.2700
            24  C8x C    10.8500  -17.5700
            25  X   F     7.2100  -18.2700
            26  C1x C    21.2100  -16.9400
            27  C1x C    22.2600  -16.6600
BOND        30
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     4   7 1 #Up
            8     7   8 1
            9     8   9 1
            10    8  10 2
            11    9  11 1
            12   11  12 1
            13   11  13 1
            14   11  14 1
            15   12  15 2
            16   15  16 1
            17   16  17 1
            18   17  18 2
            19   12  18 1
            20   17  19 1
            21   19  20 2
            22   20  21 1
            23   21  22 2
            24   22  23 1
            25   23  24 2
            26   19  24 1
            27   22  25 1
            28    6  26 1
            29    3  27 1
            30   27  26 1

» Japanese version   » Back

DBGET integrated database retrieval system