Molecule Details
InChIKeyZHXUEUKVDMWSKV-UHFFFAOYSA-N
Compound NameTebufelone
Canonical SMILESC#CCCCC(=O)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1
Clinical Status Clinical Multi-Target
Targets (Human+Pathogen)2
Pfam Stratification Homologous
Avg pChEMBL7.0
SourceChEMBL;BindingDB;TTD_MultiTarget
2D Structure
2D structure
Activity Profile
DrugBank Annotations
DrugBank ID DB21002
Drug NameTebufelone
CAS Number112018-00-5
Groups experimental
ATC Codes nan
DescriptionTebufelone is a small molecule drug. Tebufelone has a monoisotopic molecular weight of 300.21 Da.

Categories: Analgesics Anti-Inflammatory Agents Benzene Derivatives Central Nervous System Agents Hydrocarbons, Acyclic Peripheral Nervous System Agents Sensory System Agents
Cross-references: BindingDB: 50063783 CHEMBL13878 ZINC: ZINC000001548581
Target Activities (2)
Target Gene Organism Category Pfam pChEMBL Type Source
P23219 PTGS1 Homo sapiens Human PF03098 7.0 pIC50 TTD_MultiTarget
P35354 PTGS2 Homo sapiens Human PF03098 7.0 IC50 ChEMBL;BindingDB
DrugBank Target Actions (3)
Target Gene Target Name Action Type
P09917 ALOX5 Polyunsaturated fatty acid 5-lipoxygenase inhibitor targets
P23219 PTGS1 Prostaglandin G/H synthase 1 inhibitor targets
P35354 PTGS2 Prostaglandin G/H synthase 2 inhibitor targets