InChIKey	QAGYKUNXZHXKMR-HKWSIXNMSA-N
Compound Name	Nelfinavir
Canonical SMILES	Cc1c(O)cccc1C(=O)N[C@@H](CSc1ccccc1)[C@H](O)CN1C[C@H]2CCCC[C@H]2C[C@H]1C(=O)NC(C)(C)C
Clinical Status	Data-mined Candidate
Targets (Human+Pathogen)	6
Pfam Stratification	Cross-Family
Avg pChEMBL	7.54
Source	BindingDB;ChEMBL

DrugBank ID	DB00220
Drug Name	Nelfinavir
CAS Number	159989-64-7
Groups	approved investigational
ATC Codes	J05AE04
Description	Nelfinavir is a potent HIV-1 protease inhibitor. It is used in combination with other antiviral drugs in the treatment of HIV in both adults and children. Nelfinavir inhibits the HIV viral proteinase enzyme which prevents cleavage of the gag-pol polyprotein, resulting in noninfectious, immature vira...

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Categories: Anti-HIV Agents Anti-Infective Agents Anti-Retroviral Agents Antiinfectives for Systemic Use Antiviral Agents Antivirals for Systemic Use BCRP/ABCG2 Inhibitors BSEP/ABCB11 Substrates Cytochrome P-450 CYP2B6 Inhibitors Cytochrome P-450 CYP2B6 Inhibitors (strength unknown) Cytochrome P-450 CYP2C19 Inducers Cytochrome P-450 CYP2C19 Inducers (strength unknown) Cytochrome P-450 CYP2C19 Substrates Cytochrome P-450 CYP2C9 Inducers Cytochrome P-450 CYP2C9 Inducers (strength unknown) Cytochrome P-450 CYP2D6 Inhibitors Cytochrome P-450 CYP2D6 Inhibitors (strength unknown) Cytochrome P-450 CYP3A Inhibitors Cytochrome P-450 CYP3A Substrates Cytochrome P-450 CYP3A4 Inhibitors Cytochrome P-450 CYP3A4 Inhibitors (strong) Cytochrome P-450 CYP3A4 Substrates Cytochrome P-450 CYP3A5 Inhibitors Cytochrome P-450 CYP3A5 Inhibitors (strong) Cytochrome P-450 CYP3A5 Substrates Cytochrome P-450 CYP3A7 Inhibitors Cytochrome P-450 CYP3A7 Inhibitors (strong) Cytochrome P-450 Enzyme Inducers Cytochrome P-450 Enzyme Inhibitors Cytochrome P-450 Substrates Direct Acting Antivirals Enzyme Inhibitors HIV Protease Inhibitors Heterocyclic Compounds, Fused-Ring Hyperglycemia-Associated Agents Isoquinolines OATP1B1/SLCO1B1 Inhibitors OATP1B3 inhibitors OCT1 inhibitors Organic Anion Transporting Polypeptide 2B1 Inhibitors P-glycoprotein inducers P-glycoprotein inhibitors P-glycoprotein substrates Potential QTc-Prolonging Agents Protease Inhibitors QTc Prolonging Agents UGT1A1 Inducers Viral Protease Inhibitors

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Cross-references: BindingDB: 518 ChEBI: 7496 CHEMBL584 ChemSpider: 57718 Drugs Product Database (DPD): 11789 C07257 D08259 PDB: 1UN PharmGKB: PA450606 PubChem:64143 PubChem:46507719 RxCUI: 134527 Therapeutic Targets Database: DAP000705 Wikipedia: Nelfinavir ZINC: ZINC000003833846