KEGG   DRUG: BaricitinibHelp
Entry
D10308                      Drug                                   

Name
Baricitinib (JAN/USAN/INN);
Olumiant (TN)
Product
Formula
C16H17N7O2S
Exact mass
371.1164
Mol weight
371.4169
Structure
Mol fileKCF fileDB search
Class
Other
 DG02020  Janus kinase inhibitor
Transporter substrate
 DG01665  ABCB1(P-GP) substrate
 DG01913  ABCG2 substrate
 DG02860  SLC22A8 (OAT3) substrate
Remark
Therapeutic category: 3999
ATC code: L04AA37
Product: D10308<JP/US>
Efficacy
Anti-inflammatory, Antirheumatic, Immunosuppressant, Janus kinase (JAK) inhibitor
  Disease
Rheumatoid arthritis [DS:H00630]
Comment
Treatment of autoimmune diseases, inflammatory disease, rheumatoid arthritis
Target
JAK1 [HSA:3716] [KO:K11217]
JAK2 [HSA:3717] [KO:K04447]
  Pathway
hsa04062  Chemokine signaling pathway
hsa04380  Osteoclast differentiation
hsa04630  JAK-STAT signaling pathway
Metabolism
Transporter: ABCB1 [HSA:5243], ABCG2 [HSA:9429], SLC22A8 [HSA:9376], SLC47A2 [HSA:146802]
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
  L04 IMMUNOSUPPRESSANTS
   L04A IMMUNOSUPPRESSANTS
    L04AA Selective immunosuppressants
     L04AA37 Baricitinib
      D10308  Baricitinib (JAN/USAN/INN) <JP/US>
Therapeutic category of drugs in Japan [BR:br08301]
 3  Agents affecting metabolism
  39  Other agents affecting metabolism
   399  Miscellaneous
    3999  Others
     D10308  Baricitinib (JAN/USAN/INN)
Target-based classification of drugs [BR:br08310]
 Protein kinases
  Non-receptor tyrosine kinases
   JAK family
    JAK1
     D10308  Baricitinib (JAN/USAN/INN) <JP/US>
    JAK2
     D10308  Baricitinib (JAN/USAN/INN) <JP/US>
New drug approvals in the USA [br08319.html]
 New Molecular Entity and New Therapeutic Biological Product Approvals
  D10308
New drug approvals in Europe [br08329.html]
 European public assessment reports (EPAR) authorised medicine
  D10308
New drug approvals in Japan [br08318.html]
 Drugs with new active ingredients
  D10308
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D10308
BRITE hierarchy
Other DBs
CAS: 1187594-09-7
PubChem: 163312339
ChEMBL: CHEMBL2105759
PDB-CCD: 3JW[PDBj]
LinkDB All DBs
KCF data Show

ATOM        26
            1   C8y C    21.8059  -18.3269
            2   C8y C    21.8059  -19.7308
            3   N5x N    20.6126  -20.4327
            4   C8x C    19.3491  -19.7308
            5   N5x N    19.3491  -18.3269
            6   C8y C    20.6126  -17.6250
            7   C8x C    23.1396  -17.9057
            8   C8x C    23.9819  -19.0288
            9   N4x N    23.1396  -20.1519
            10  C8y C    20.6126  -16.2211
            11  C8x C    19.4895  -15.3787
            12  N4y N    19.9107  -14.1152
            13  N5x N    21.3146  -14.1152
            14  C8x C    21.7357  -15.3787
            15  C1z C    18.7174  -13.4133
            16  C1x C    17.8049  -12.3604
            17  N1y N    16.7519  -13.2729
            18  C1x C    17.6645  -14.3258
            19  C1b C    19.6299  -12.3604
            20  C3b C    21.1040  -12.3604
            21  N3a N    22.5079  -12.3604
            22  S4a S    15.3481  -13.2729
            23  O3c O    15.3481  -11.8690
            24  O3c O    15.3481  -14.6768
            25  C1b C    13.9442  -13.2729
            26  C1a C    13.2422  -12.0572
BOND        29
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     1   7 1
            8     7   8 2
            9     8   9 1
            10    2   9 1
            11    6  10 1
            12   10  11 2
            13   11  12 1
            14   12  13 1
            15   13  14 2
            16   10  14 1
            17   15  12 1
            18   15  16 1
            19   16  17 1
            20   17  18 1
            21   15  18 1
            22   15  19 1
            23   19  20 1
            24   20  21 3
            25   17  22 1
            26   22  23 2
            27   22  24 2
            28   22  25 1
            29   25  26 1

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