Molecule Details
InChIKeyQDLHCMPXEPAAMD-QAIWCSMKSA-N
Compound NameWortmannin
Canonical SMILESCOC[C@H]1OC(=O)c2coc3c2[C@@]1(C)C1=C(C3=O)[C@@H]2CCC(=O)[C@@]2(C)C[C@H]1OC(C)=O
Clinical Status Clinical Multi-Target
Targets (Human+Pathogen)13
Pfam Stratification Cross-Family
Avg pChEMBL7.5
SourceChEMBL;BindingDB;TTD_MultiTarget
2D Structure
2D structure
Activity Profile
DrugBank Annotations
DrugBank ID DB08059
Drug NameWortmannin
CAS Number19545-26-7
Groups experimental
ATC Codes nan
DescriptionWortmannin is a steroid metabolite of _Penicillium funiculosum_ and _Talaromyces wortmannii_ fungi. This drug acts as a nonspecific, covalent inhibitor of phosphoinositide 3-kinase enzymes (PI3Ks).

Categories: Androstadienes Androstanes Androstenes Anti-Infective Agents Antidepressive Agents Antifungal Agents Central Nervous System Depressants Enzyme Inhibitors Fused-Ring Compounds Hormone Antagonists Hormones, Hormone Substitutes, and Hormone Antagonists Immunologic Factors Immunosuppressive Agents Insulin Antagonists Protein Kinase Inhibitors Radiation-Sensitizing Agents Serotonin Agents Serotonin Receptor Antagonists Steroids
Cross-references: BindingDB: 15234 ChEBI: 52289 CHEMBL428496 ChemSpider: 276037 C15181 PDB: KWT PubChem:312145 PubChem:99444530 Wikipedia: Wortmannin ZINC: ZINC000001619592
Target Activities (13)
Target Gene Organism Category Pfam pChEMBL Type Source
Q8NEB9 PIK3C3 Homo sapiens Human PF00454 PF00792 PF00613 8.4 IC50 ChEMBL
O00329 PIK3CD Homo sapiens Human PF00454 PF00792 PF02192 PF00794 PF00613 8.2 IC50 ChEMBL;BindingDB
P27986 PIK3R1 Homo sapiens Human PF16454 PF00620 PF00017 8.0 IC50 ChEMBL;BindingDB
P53350 PLK1 Homo sapiens Human PF00069 PF00659 7.9 IC50 ChEMBL;BindingDB
P42336 PIK3CA Homo sapiens Human PF00454 PF00792 PF02192 PF00794 PF00613 7.9 IC50 ChEMBL;BindingDB
P42338 PIK3CB Homo sapiens Human PF00454 PF00792 PF02192 PF00794 PF00613 7.9 IC50 ChEMBL;BindingDB
P48736 PIK3CG Homo sapiens Human PF00454 PF00792 PF00794 PF00613 PF19710 7.8 IC50 ChEMBL;BindingDB
P42345 MTOR Homo sapiens Human PF02259 PF02260 PF08771 PF23593 PF11865 PF00454 7.4 pIC50 TTD_MultiTarget
Q9H4B4 PLK3 Homo sapiens Human PF00069 PF00659 7.3 IC50 ChEMBL;BindingDB
P78527 PRKDC Homo sapiens Human PF20500 PF20502 PF08163 PF19704 PF02259 PF02260 PF00454 6.9 Ki ChEMBL;BindingDB
Q15746 MYLK Homo sapiens Human PF16620 PF00041 PF07679 PF00069 6.8 IC50 ChEMBL;BindingDB
P42356 PI4KA Homo sapiens Human PF00454 PF00613 PF19274 6.5 IC50 ChEMBL
Q9UBF8 PI4KB Homo sapiens Human PF00454 PF21245 6.4 IC50 ChEMBL
DrugBank Target Actions (5)
Target Gene Target Name Action Type
P27986 PIK3R1 Phosphatidylinositol 3-kinase regulatory subunit alpha binder targets
P42336 PIK3CA Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform binder targets
P53350 PLK1 Serine/threonine-protein kinase PLK1 binder targets
O00329 PIK3CD Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform inhibitor targets
P48736 PIK3CG Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform inhibitor targets