LENVATINIB

Search structure
Synonyms:
Status: Approved (2015)
Entry Type: Small molecule
Molecule Category: Parent
ATC: L01EX08
UNII: EE083865G2

Structure
InChI Key WOSKHXYHFSIKNG-UHFFFAOYSA-N
Smile COc1cc2nccc(Oc3ccc(NC(=O)NC4CC4)c(Cl)c3)c2cc1C(N)=O
InChI
InChI=1S/C21H19ClN4O4/c1-29-19-10-17-13(9-14(19)20(23)27)18(6-7-24-17)30-12-4-5-16(15(22)8-12)26-21(28)25-11-2-3-11/h4-11H,2-3H2,1H3,(H2,23,27)(H2,25,26,28)

Physicochemical Descriptors

Property Name Value
Molecular Formula C21H19ClN4O4
Molecular Weight 426.86
AlogP 4.07
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 6.0
Polar Surface Area 115.57
Molecular species NEUTRAL
Aromatic Rings 3.0
Heavy Atoms 30.0

Pharmacology

Primary Target
fms related receptor tyrosine kinase 4
kinase insert domain receptor
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Kinase Protein Kinase Atypical protein kinase group Atypical protein kinase BCR family
- - 4113 - -
Enzyme Kinase Protein Kinase CAMK protein kinase group CAMK protein kinase MAPKAPK family CAMK protein kinase MAPKAPK subfamily
- - 63 - -
Enzyme Kinase Protein Kinase CMGC protein kinase group CMGC protein kinase MAPK family CMGC protein kinase p38 subfamily
- - 217 - -
Enzyme Kinase Protein Kinase Other protein kinase group Other protein kinase AUR family
- - 1781 - -
Enzyme Kinase Protein Kinase STE protein kinase group STE protein kinase STE11 family STE protein kinase ASK
- - 1575 - -
Enzyme Kinase Protein Kinase STE protein kinase group STE protein kinase STE20 family STE protein kinase KHS subfamily
- - 3117 - -
Enzyme Kinase Protein Kinase STE protein kinase group STE protein kinase STE20 family STE protein kinase MSN subfamily
- - 565 - -
Enzyme Kinase Protein Kinase STE protein kinase group STE protein kinase STE20 family STE protein kinase SLK subfamily
- - 3851 - -
Enzyme Kinase Protein Kinase STE protein kinase group STE protein kinase STE7 family
- - 2910 - -
Enzyme Kinase Protein Kinase TKL protein kinase group TKL protein kinase RIPK family
- - 11 - -
Enzyme Kinase Protein Kinase TKL protein kinase group
- - 11 - -
Enzyme Kinase Protein Kinase TK protein kinase group Tyrosine protein kinase Abl family
- - 3771 - -
Enzyme Kinase Protein Kinase TK protein kinase group Tyrosine protein kinase DDR family
- - 218 - -
Enzyme Kinase Protein Kinase TK protein kinase group Tyrosine protein kinase FGFR family
- 1.9-311 - - -
Enzyme Kinase Protein Kinase TK protein kinase group Tyrosine protein kinase PDGFR family
- 39 316 - -
Enzyme Kinase Protein Kinase TK protein kinase group Tyrosine protein kinase Ret family
- 1.5-35 9 1.5-1.5 -
Enzyme Kinase Protein Kinase TK protein kinase group Tyrosine protein kinase Src family
- - 173 - -
Enzyme Kinase Protein Kinase TK protein kinase group Tyrosine protein kinase VEGFR family
- 0.7-4 2.1 - -
Enzyme Lyase
- - 2806 132.7 -
Enzyme Oxidoreductase
- - 1523 - -
Enzyme Transferase
- - - - 5.428-26.36
Enzyme
- 0.7-4 11 1.5-1.5 5.428-26.36
Epigenetic regulator Eraser Histone deacetylase HDAC class IIb
- - - - 2.87-41.33
Other cytosolic protein
- 10 4113 - -
Unclassified protein
- 10 - - -

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Neoplasms 4 D009369 ClinicalTrials
Carcinoma, Renal Cell 3 D002292 ClinicalTrials
Thyroid Neoplasms 3 D013964 ClinicalTrials
Colorectal Neoplasms 3 D015179 ClinicalTrials
Urinary Bladder Neoplasms 3 D001749 ClinicalTrials
Cholangiocarcinoma 3 D018281 ClinicalTrials
Carcinoma, Squamous Cell 3 D002294 ClinicalTrials
Esophageal Neoplasms 3 D004938 ClinicalTrials
Carcinoma, Renal Cell 3 D002292 ClinicalTrials
Carcinoma, Renal Cell 3 D002292 ClinicalTrials
Thyroid Neoplasms 3 D013964 ClinicalTrials
Carcinoma, Renal Cell 3 D002292 ClinicalTrials
Cholangiocarcinoma 3 D018281 ClinicalTrials
Endometrial Neoplasms 3 D016889 ClinicalTrials
Carcinoma, Hepatocellular 3 D006528 ClinicalTrials
Melanoma 3 D008545 ClinicalTrials
Thyroid Neoplasms 3 D013964 ClinicalTrials
Endometrial Neoplasms 3 D016889 ClinicalTrials
Carcinoma, Non-Small-Cell Lung 3 D002289 ClinicalTrials
Esophageal Neoplasms 3 D004938 ClinicalTrials
Endometrial Neoplasms 3 D016889 ClinicalTrials
Kidney Neoplasms 2 D007680 ClinicalTrials
Stomach Neoplasms 2 D013274 ClinicalTrials
Sarcoma, Kaposi 2 D012514 ClinicalTrials
Uterine Cervical Neoplasms 2 D002583 ClinicalTrials
Thymoma 2 D013945 ClinicalTrials
Carcinoma, Adenoid Cystic 2 D003528 ClinicalTrials
Adenocarcinoma, Follicular 2 D018263 ClinicalTrials
Adenocarcinoma of Lung 2 D000077192 ClinicalTrials
Mesothelioma 2 D008654 ClinicalTrials
Osteosarcoma 2 D012516 ClinicalTrials
Neuroendocrine Tumors 2 D018358 ClinicalTrials
Stomach Neoplasms 2 D013274 ClinicalTrials
Biliary Tract Neoplasms 2 D001661 ClinicalTrials
Breast Neoplasms 2 D001943 ClinicalTrials
Ovarian Neoplasms 2 D010051 ClinicalTrials
Adenocarcinoma 2 D000230 ClinicalTrials
Sarcoma 2 D012509 ClinicalTrials
Meningeal Carcinomatosis 2 D055756 ClinicalTrials
Carcinoma, Neuroendocrine 2 D018278 ClinicalTrials
Small Cell Lung Carcinoma 2 D055752 ClinicalTrials
Carcinoma, Merkel Cell 2 D015266 ClinicalTrials
Uterine Cervical Neoplasms 2 D002583 ClinicalTrials
Stomach Neoplasms 2 D013274 ClinicalTrials
Biliary Tract Neoplasms 2 D001661 ClinicalTrials
Retroviridae Infections 2 D012192 ClinicalTrials
Adrenal Cortex Neoplasms 2 D000306 ClinicalTrials
Vulvar Neoplasms 2 D014846 ClinicalTrials
Liver Neoplasms 2 D008113 ClinicalTrials
Mesothelioma 2 D008654 ClinicalTrials
Ovarian Neoplasms 2 D010051 ClinicalTrials
Breast Neoplasms 2 D001943 ClinicalTrials
Paraganglioma 2 D010235 ClinicalTrials
Adenocarcinoma 2 D000230 ClinicalTrials
Central Nervous System Neoplasms 1 D016543 ClinicalTrials
Rectal Neoplasms 1 D012004 ClinicalTrials
Kidney Diseases 1 D007674 ClinicalTrials
Lymphoma 1 D008223 ClinicalTrials
Glioblastoma 1 D005909 ClinicalTrials
Carcinoma, Pancreatic Ductal 1 D021441 ClinicalTrials
Liver Diseases 1 D008107 ClinicalTrials

Related Entries

Scaffolds

Salt

Cross References

Resources Reference
CAS NUMBER 417716-92-8
ChEBI 85994
ChEMBL CHEMBL1289601
DrugBank DB09078
DrugCentral 4942
EPA CompTox DTXSID50194605
FDA SRS EE083865G2
Guide to Pharmacology 7426
PDB LEV
PharmGKB PA166153472
PubChem 9823820
SureChEMBL SCHEMBL864638
ZINC ZINC000003816292
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