| Entry |
|
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| Name |
Gusacitinib hydrochloride (USAN) |
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| Formula |
C24H28N8O2. HCl
|
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| Exact mass |
496.2102
|
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| Mol weight |
496.99
|
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| Structure |
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| Class |
Antineoplastic
DG01918 Tyrosine kinase inhibitor
Anti-inflammatory
DG01985 Disease modifying anti-rheumatic drug (DMARD)
DG02020 JAK inhibitor
|
|---|
| Remark |
|
|---|
| Efficacy |
Antineoplastic |
|---|
| Target |
|
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| Pathway |
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| Interaction |
|
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| Brite |
Drug groups [BR:br08330]
Antineoplastic
DG01918 Tyrosine kinase inhibitor
DG03080 Gusacitinib
D11677 Gusacitinib hydrochloride
Anti-inflammatory
DG01985 Disease modifying anti-rheumatic drug (DMARD)
DG02020 JAK inhibitor
DG03080 Gusacitinib
D11677 Gusacitinib hydrochloride
Target-based classification of drugs [BR:br08310]
Protein kinases
Non-receptor tyrosine kinases
SYK family
SYK
D11677 Gusacitinib hydrochloride (USAN)
JAK family
JAK1
D11677 Gusacitinib hydrochloride (USAN)
JAK2
D11677 Gusacitinib hydrochloride (USAN)
JAK3
D11677 Gusacitinib hydrochloride (USAN)
Drug groups [BR:br08330]
Antineoplastic
DG01918 Tyrosine kinase inhibitor
DG03080 Gusacitinib
Anti-inflammatory
DG01985 Disease modifying anti-rheumatic drug (DMARD)
DG02020 JAK inhibitor
DG03080 Gusacitinib
|
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 35
1 N5x N 12.5913 -13.3640
2 N4x N 12.5913 -14.7634
3 C8y C 13.7808 -15.4631
4 C8y C 15.0403 -14.7634
5 C8y C 15.0403 -13.3640
6 C8x C 13.7808 -12.6643
7 C8y C 16.2297 -15.4631
8 N5x N 17.4192 -14.7634
9 C8y C 17.4192 -13.3640
10 N5x N 16.2297 -12.6643
11 N1y N 18.6087 -12.6643
12 C1x C 19.7982 -13.3640
13 C1x C 21.0576 -12.6643
14 C1y C 21.0576 -11.2649
15 C1x C 19.8681 -10.5653
16 C1x C 18.6087 -11.2649
17 C1b C 22.2471 -10.5653
18 C3b C 23.4365 -11.2649
19 N3a N 24.6960 -11.9646
20 N1b N 16.2297 -16.8625
21 C8y C 17.4192 -17.5622
22 C8x C 17.4192 -18.9615
23 C8x C 18.6787 -19.6612
24 C8y C 19.8681 -18.9615
25 C8x C 19.8681 -17.5622
26 C8x C 18.6787 -16.8625
27 N1y N 21.0576 -19.6612
28 C1x C 21.0576 -21.0606
29 C1x C 22.3170 -21.7603
30 C1y C 23.5065 -21.0606
31 C1x C 23.5065 -19.6612
32 C1x C 22.3170 -18.9615
33 O1a O 24.6960 -21.7603
34 O5x O 13.7808 -16.8625
35 X Cl 26.1800 -16.0300
BOND 38
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 2
7 4 7 2
8 7 8 1
9 8 9 2
10 9 10 1
11 5 10 2
12 9 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 14 15 1
17 15 16 1
18 11 16 1
19 14 17 1
20 17 18 1
21 18 19 3
22 7 20 1
23 20 21 1
24 21 22 2
25 22 23 1
26 23 24 2
27 24 25 1
28 25 26 2
29 21 26 1
30 24 27 1
31 27 28 1
32 28 29 1
33 29 30 1
34 30 31 1
35 31 32 1
36 27 32 1
37 30 33 1
38 3 34 2
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