Molecule Details
InChIKeySUJUHGSWHZTSEU-FYBSXPHGSA-N
Compound NameTipranavir
Canonical SMILESCCC[C@@]1(CCc2ccccc2)CC(O)=C([C@H](CC)c2cccc(NS(=O)(=O)c3ccc(C(F)(F)F)cn3)c2)C(=O)O1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)2
Pfam Stratification Homologous
Avg pChEMBL9.31
SourceBindingDB;ChEMBL
2D Structure
2D structure
Activity Profile
DrugBank Annotations
DrugBank ID DB00932
Drug NameTipranavir
CAS Number174484-41-4
Groups approved
ATC Codes J05AE09
DescriptionTipranavir is a sulfonamide-containing dyhydropyrone and a nonpeptidic protease inhibitor that targets the HIV protease. Tipranavir and ritonavir are coadministered to treat HIV.

Categories: Amides Anti-HIV Agents Anti-Infective Agents Anti-Retroviral Agents Antiinfectives for Systemic Use Antiviral Agents Antivirals for Systemic Use BSEP/ABCB11 Inhibitors BSEP/ABCB11 Substrates Cytochrome P-450 CYP2C19 Inhibitors Cytochrome P-450 CYP2C19 Inhibitors (weak) Cytochrome P-450 CYP2C19 Substrates Cytochrome P-450 CYP2D6 Inhibitors Cytochrome P-450 CYP2D6 Inhibitors (moderate) Cytochrome P-450 CYP2D6 Substrates 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 Enzyme Inhibitors Cytochrome P-450 Substrates Direct Acting Antivirals Drugs causing inadvertant photosensitivity Enzyme Inhibitors HIV Protease Inhibitors Hepatotoxic Agents Hyperglycemia-Associated Agents OATP1B1/SLCO1B1 Inhibitors OATP1B3 inhibitors Organic Anion Transporting Polypeptide 2B1 Inhibitors P-glycoprotein inducers P-glycoprotein inhibitors P-glycoprotein substrates Photosensitizing Agents Protease Inhibitors Pyrans Sulfones Sulfur Compounds UGT1A1 Inducers
Cross-references: BindingDB: 50479982 ChEBI: 63628 CHEMBL222559 ChemSpider: 10482313 Drugs Product Database (DPD): 12684 PDB: TPV PharmGKB: PA163522473 PubChem:54682461 PubChem:46506257 RxCUI: 190548 Therapeutic Targets Database: DAP001085 Wikipedia: Tipranavir ZINC: ZINC000100016058
Target Activities (2)
Target Gene Organism Category Pfam pChEMBL Type Source
Q9YQ12 protease Human immunodeficiency virus type 1 Pathogen PF00077 11.1 Ki BindingDB
Q72874 pol Human immunodeficiency virus type 1 Pathogen PF00077 7.5 IC50 ChEMBL
DrugBank Target Actions (17)
Target Gene Target Name Action Type
P22309 UGT1A1 UDP-glucuronosyltransferase 1A1 inducer enzymes
P08684 CYP3A4 Cytochrome P450 3A4 inhibitor enzymes
P10635 CYP2D6 Cytochrome P450 2D6 inhibitor enzymes
P33261 CYP2C19 Cytochrome P450 2C19 inhibitor enzymes
P08684 CYP3A4 Cytochrome P450 3A4 substrate enzymes
P10635 CYP2D6 Cytochrome P450 2D6 substrate enzymes
P33261 CYP2C19 Cytochrome P450 2C19 substrate enzymes
Q72874 pol Pol polyprotein inhibitor targets
P03366 gag-pol Gag-Pol polyprotein modulator targets
P08183 ABCB1 ATP-dependent translocase ABCB1 inducer transporters
O94956 SLCO2B1 Solute carrier organic anion transporter family member 2B1 inhibitor transporters
O95342 ABCB11 Bile salt export pump inhibitor transporters
P08183 ABCB1 ATP-dependent translocase ABCB1 inhibitor transporters
Q9NPD5 SLCO1B3 Solute carrier organic anion transporter family member 1B3 inhibitor transporters
Q9Y6L6 SLCO1B1 Solute carrier organic anion transporter family member 1B1 inhibitor transporters
O95342 ABCB11 Bile salt export pump substrate transporters
P08183 ABCB1 ATP-dependent translocase ABCB1 substrate transporters