Molecule Details
InChIKeyPZJIORSTWTVMPM-UZRFBLNJSA-N
Compound NameCID 66649578
Canonical SMILESCOC[C@@H](Oc1cc(C[C@@H]2C[S@@+]([O-])C[C@H](NCc3cc(C(C)(C)C)ccc3F)[C@H]2O)cc(F)c1N)C(F)(F)F
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Cross-Family
Avg pChEMBL7.08
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P56817 BACE1 Homo sapiens Human PF00026 7.7 IC50 ChEMBL
P08684 CYP3A4 Homo sapiens Human PF00067 7.0 IC50 ChEMBL
P07339 CTSD Homo sapiens Human PF07966 PF00026 6.5 IC50 ChEMBL;BindingDB