Molecule Details
InChIKeyNGOLMNWQNHWEKU-DEOSSOPVSA-N
Compound NameButyrolactone I
Canonical SMILESCOC(=O)[C@@]1(Cc2ccc(O)c(CC=C(C)C)c2)OC(=O)C(O)=C1c1ccc(O)cc1
Clinical Status Clinical Multi-Target
Targets (Human+Pathogen)3
Pfam Stratification Cross-Family
Avg pChEMBL6.22
SourceChEMBL;TTD_MultiTarget
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P06493 CDK1 Homo sapiens Human PF00069 6.2 pIC50 TTD_MultiTarget
P14635 CCNB1 Homo sapiens Human PF02984 PF00134 6.2 IC50 ChEMBL
P24941 CDK2 Homo sapiens Human PF00069 6.2 pIC50 TTD_MultiTarget