Entry
Name
Oclacitinib maleate (USAN)
Formula
C15H23N5O2S. C4H4O4
Exact mass
453.1682
Mol weight
453.51
Structure
Mol file KCF file DB search
Class
Anti-inflammatory
DG01985 Disease modifying anti-rheumatic drug (DMARD)
DG02020 JAK inhibitor
Remark
Efficacy
Antipruritic, Immunosuppressant (veterinary), Janus kinase (JAK) inhibitor
Comment
Treatment of atopic dermatitis and pruritus, veterinary pharmaceutical
Target
Interaction
DDI search
Brite
Drug groups [BR:br08330 ]
Anti-inflammatory
DG01985 Disease modifying anti-rheumatic drug (DMARD)
DG02020 JAK inhibitor
DG02005 Oclacitinib
D10142 Oclacitinib maleate
Target-based classification of drugs [BR:br08310 ]
Protein kinases
Non-receptor tyrosine kinases
JAK family
JAK1
D10142 Oclacitinib maleate (USAN)
Drug groups [BR:br08330 ]
Anti-inflammatory
DG01985 Disease modifying anti-rheumatic drug (DMARD)
DG02020 JAK inhibitor
DG02005 Oclacitinib
BRITE hierarchy
Other DBs
LinkDB
All DBs
KCF data
Show ATOM 31
1 N4x N 25.9000 -22.5400
2 C8x C 25.9000 -23.9400
3 N5x N 27.0900 -24.6400
4 C8y C 28.3500 -23.9400
5 C8y C 28.3500 -22.5400
6 C8y C 27.0900 -21.8400
7 N1c N 27.0900 -20.4400
8 C1y C 25.9000 -19.7400
9 C1a C 28.2800 -19.7400
10 C1x C 25.9000 -18.3400
11 C1x C 24.6400 -17.6400
12 C1y C 23.4500 -18.3400
13 C1x C 23.4500 -19.7400
14 C1x C 24.6400 -20.4400
15 C1b C 22.1900 -17.6400
16 S4a S 21.0000 -18.3400
17 N1b N 19.8100 -17.6400
18 C1a C 18.6200 -18.3400
19 N5x N 29.6800 -24.3600
20 C8x C 30.4500 -23.2400
21 C8x C 29.6800 -22.1200
22 O3c O 20.3000 -19.5300
23 O3c O 21.7000 -19.5300
24 C2b C 34.8600 -20.7900
25 C2b C 36.2600 -20.7900
26 C6a C 36.9600 -22.0024
27 C6a C 34.1600 -22.0024
28 O6a O 38.3598 -22.0024
29 O6a O 36.2696 -23.1979
30 O6a O 32.7602 -22.0024
31 O6a O 34.8504 -23.1979
BOND 32
1 1 2 1
2 2 3 2
3 3 4 1
4 4 5 1
5 5 6 2
6 1 6 1
7 6 7 1
8 7 8 1 #Down
9 7 9 1
10 8 10 1
11 10 11 1
12 11 12 1
13 12 13 1
14 13 14 1
15 8 14 1
16 12 15 1 #Up
17 15 16 1
18 16 17 1
19 17 18 1
20 4 19 2
21 19 20 1
22 20 21 2
23 5 21 1
24 16 22 2
25 16 23 2
26 24 25 2
27 25 26 1
28 24 27 1
29 26 28 2
30 26 29 1
31 27 30 1
32 27 31 2