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Details

Stereochemistry ACHIRAL
Molecular Formula C23H22FN3O3
Molecular Weight 407.4375
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Catequentinib

SMILES

COC1=CC2=C(OC3=C(F)C4=C(NC(C)=C4)C=C3)C=CN=C2C=C1OCC5(N)CC5

InChI

InChIKey=KSMZEXLVHXZPEF-UHFFFAOYSA-N
InChI=1S/C23H22FN3O3/c1-13-9-15-16(27-13)3-4-19(22(15)24)30-18-5-8-26-17-11-21(20(28-2)10-14(17)18)29-12-23(25)6-7-23/h3-5,8-11,27H,6-7,12,25H2,1-2H3

HIDE SMILES / InChI

Description

AL3818 (anlotinib) is a receptor tyrosine kinase inhibitor targeting vascular endothelial growth factor receptors (VEGFR1, VEGFR2/KDR, and VEGFR3), stem cell factor receptor (C-kit), platelet-derived growth factor (PDGFβ), and fibroblast growth factor receptors (FGFR1, FGFR2, and FGFR3). Anlotibib is a kind of innovative medicines approved by State Food and Drug Administration(SFDA:2011L00661) which was researched by Jiangsu Chia-tai Tianqing Pharmaceutical Co., Ltd. Phase III development is underway for the treatment of thyroid cancer, gastric cancer, leiomyosarcoma; non-small cell lung cancer; synovial sarcoma; thyroid cancer etc.

Originator

Approval Year

Targets

Primary TargetPharmacologyConditionPotency
0.2 nM [IC50]
1.0 nM [IC50]
7.7 null [pIC50]

Conditions

ConditionModalityTargetsHighest PhaseProduct
Primary
Unknown
Primary
Unknown
Primary
Unknown
Primary
Unknown
Primary
Unknown
Primary
Unknown
Primary
Unknown

Cmax

ValueDoseCo-administeredAnalytePopulation
5.8 ng/mL
5 mg single, oral
ANLOTINIB plasma
Homo sapiens
5.8 ng/mL
10 mg single, oral
ANLOTINIB plasma
Homo sapiens
10.5 ng/mL
12 mg single, oral
ANLOTINIB plasma
Homo sapiens
15.8 ng/mL
16 mg single, oral
ANLOTINIB plasma
Homo sapiens

AUC

ValueDoseCo-administeredAnalytePopulation
687 ng × h/mL
5 mg single, oral
ANLOTINIB plasma
Homo sapiens
562 ng × h/mL
10 mg single, oral
ANLOTINIB plasma
Homo sapiens
1066 ng × h/mL
12 mg single, oral
ANLOTINIB plasma
Homo sapiens
1585 ng × h/mL
16 mg single, oral
ANLOTINIB plasma
Homo sapiens

T1/2

ValueDoseCo-administeredAnalytePopulation
102 h
5 mg single, oral
ANLOTINIB plasma
Homo sapiens
95 h
10 mg single, oral
ANLOTINIB plasma
Homo sapiens
116 h
12 mg single, oral
ANLOTINIB plasma
Homo sapiens
98 h
16 mg single, oral
ANLOTINIB plasma
Homo sapiens

Funbound

ValueDoseCo-administeredAnalytePopulation
7.9%
ANLOTINIB plasma
Homo sapiens

Doses

AEs

PubMed

Sample Use Guides

In Vivo Use Guide
Anlotinib (AL3818) 12 mg orally administered once daily in 21-day cycles (14 days on treatment, 7 days off treatment)
Route of Administration: Oral
In Vitro Use Guide
AN3CA cells appeared the most sensitive to AL3818 with an IC50 value of 84 nM. The other cell lines were approximately 28- to 550-fold less sensitive to AL3818. HEC1B had an IC50 value of 46 uM, and MFE296 cells were sensitive to AL3818, with an IC50 value of 2.9 uM compared with 3.2, 28.9, 29, and 40 uM for Ishikawa, MFE280, KLE, and HEC1A, respectively.