InChIKey	HHZIURLSWUIHRB-UHFFFAOYSA-N
Compound Name	Nilotinib
Canonical SMILES	Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
Clinical Status	Clinical Multi-Target
Targets (Human+Pathogen)	57
Pfam Stratification	Cross-Family
Avg pChEMBL	6.76
Source	BindingDB;ChEMBL;TTD_MultiTarget

DrugBank ID	DB04868
Drug Name	Nilotinib
CAS Number	641571-10-0
Groups	approved investigational
ATC Codes	L01EA03
Description	Nilotinib, also known as AMN107, is a tyrosine kinase inhibitor under investigation as a possible treatment for chronic myelogenous leukemia (CML). A Phase I clinical trial in 2006 showed that this drug was relatively safe and offered significant therapeutic benefits in cases of CML which were found...

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Categories: Antineoplastic Agents Antineoplastic and Immunomodulating Agents BCRP/ABCG2 Inhibitors BCRP/ABCG2 Substrates Bcr-Abl Tyrosine Kinase Inhibitors Cytochrome P-450 CYP2B6 Inducers Cytochrome P-450 CYP2B6 Inducers (strength unknown) Cytochrome P-450 CYP2C8 Inducers Cytochrome P-450 CYP2C8 Inducers (strength unknown) Cytochrome P-450 CYP2C8 Inhibitors Cytochrome P-450 CYP2C8 Inhibitors (moderate) Cytochrome P-450 CYP2C9 Inhibitors Cytochrome P-450 CYP2C9 Inhibitors (strength unknown) Cytochrome P-450 CYP2D6 Inhibitors Cytochrome P-450 CYP2D6 Inhibitors (moderate) Cytochrome P-450 CYP3A Inhibitors Cytochrome P-450 CYP3A Substrates Cytochrome P-450 CYP3A4 Inhibitors Cytochrome P-450 CYP3A4 Inhibitors (strength unknown) Cytochrome P-450 CYP3A4 Inhibitors (strong) Cytochrome P-450 CYP3A4 Substrates Cytochrome P-450 CYP3A4 Substrates with a Narrow Therapeutic Index Cytochrome P-450 Enzyme Inducers Cytochrome P-450 Enzyme Inhibitors Cytochrome P-450 Substrates Drugs causing inadvertant photosensitivity Enzyme Inhibitors Highest Risk QTc-Prolonging Agents Hyperglycemia-Associated Agents Immunosuppressive Agents Kinase Inhibitor Myelosuppressive Agents Narrow Therapeutic Index Drugs OATP1B1/SLCO1B1 Inhibitors P-glycoprotein inhibitors P-glycoprotein substrates P-glycoprotein substrates with a Narrow Therapeutic Index Photosensitizing Agents Protein Kinase Inhibitors QTc Prolonging Agents Tyrosine Kinase Inhibitors UGT1A1 Inhibitors

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Cross-references: BindingDB: 50237710 ChEBI: 52172 CHEMBL255863 ChemSpider: 559260 Drugs Product Database (DPD): 20378 D08953 PDB: NIL PharmGKB: PA165958345 PubChem:644241 PubChem:99443226 RxCUI: 662281 Wikipedia: Nilotinib ZINC: ZINC000006716957