Entry |
|
Name |
Sunitinib (INN) |
Formula |
C22H27FN4O2
|
Exact mass |
398.2118
|
Mol weight |
398.4738
|
Structure |
|
Simcomp |
|
Class |
Antineoplastic
DG01918 Tyrosine kinase inhibitor
DG01917 Receptor tyrosine kinase inhibitor
Metabolizing enzyme substrate
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
|
Remark |
Product (DG00712): | D06402<JP/US> |
|
Efficacy |
Antineoplastic, Angiogenesis inhibitor, Receptor tyrosine kinase inhibitor |
Target |
|
Pathway |
|
Metabolism |
Enzyme: CYP3A4 [HSA: 1576]
|
Interaction |
|
Structure map |
map07045 | Antineoplastics - protein kinase inhibitors |
|
Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
L01 ANTINEOPLASTIC AGENTS
L01E PROTEIN KINASE INHIBITORS
L01EX Other protein kinase inhibitors
L01EX01 Sunitinib
D08552 Sunitinib (INN)
Drug groups [BR:br08330]
Antineoplastic
DG01918 Tyrosine kinase inhibitor
DG01917 Receptor tyrosine kinase inhibitor
DG00712 Sunitinib
D08552 Sunitinib
Metabolizing enzyme substrate
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
DG00712 Sunitinib
D08552 Sunitinib
Target-based classification of drugs [BR:br08310]
Protein kinases
Receptor tyrosine kinases (RTK)
PDGFR family
PDGFR
D08552 Sunitinib (INN)
KIT (CD117)
D08552 Sunitinib (INN)
FLT3 (CD135)
D08552 Sunitinib (INN)
VEGFR family
VEGFR1 (FLT1)
D08552 Sunitinib (INN)
VEGFR2 (KDR)
D08552 Sunitinib (INN)
VEGFR3 (FLT4)
D08552 Sunitinib (INN)
RET family
RET
D08552 Sunitinib (INN)
Cytokines and receptors
Cytokine receptors
CSF and other factor receptors
CSF1R (FMS, CD115)
D08552 Sunitinib (INN)
Drug metabolizing enzymes and transporters [br08309.html]
Drug metabolizing enzymes
D08552
Drug groups [BR:br08330]
Antineoplastic
DG01918 Tyrosine kinase inhibitor
DG01917 Receptor tyrosine kinase inhibitor
DG00712 Sunitinib
Metabolizing enzyme substrate
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
DG00712 Sunitinib
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 29
1 C8x C 18.1300 -13.6500
2 C8x C 16.9400 -14.3500
3 C8y C 16.9400 -15.7500
4 C8x C 18.1300 -16.4500
5 C8y C 19.3200 -15.7500
6 C8y C 19.3200 -14.3500
7 C2y C 20.7200 -16.1700
8 C5x C 21.4900 -15.0500
9 N1x N 20.7200 -13.9300
10 X F 15.7500 -16.4500
11 O5x O 22.8900 -15.0500
12 C2b C 20.7200 -17.5700
13 C8y C 21.9100 -18.2700
14 C8y C 21.9100 -19.6700
15 C8y C 23.2400 -20.0900
16 C8y C 24.0100 -18.9700
17 N4x N 23.2400 -17.8500
18 C1a C 20.7200 -20.5100
19 C1a C 25.4800 -18.9700
20 C5a C 23.2400 -21.5600
21 O5a O 22.0500 -22.2600
22 N1b N 24.5000 -22.2600
23 C1b C 25.6900 -21.5600
24 C1b C 26.8800 -22.2600
25 N1c N 28.0700 -21.5600
26 C1b C 29.2600 -22.2600
27 C1a C 30.4500 -21.5600
28 C1b C 28.0700 -20.0900
29 C1a C 29.2600 -19.4600
BOND 31
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 5 7 1
8 7 8 1
9 8 9 1
10 6 9 1
11 3 10 1
12 8 11 2
13 7 12 2
14 12 13 1
15 13 14 2
16 14 15 1
17 15 16 2
18 16 17 1
19 13 17 1
20 14 18 1
21 16 19 1
22 15 20 1
23 20 21 2
24 20 22 1
25 22 23 1
26 23 24 1
27 24 25 1
28 25 26 1
29 26 27 1
30 25 28 1
31 28 29 1
|