Molecule Details
InChIKeyDQUIQKUFQPXKNE-UHFFFAOYSA-O
Compound NameUS10035794, Example 5
Canonical SMILESCc1cc(C#N)cnc1C(=O)Nc1cccc(C2(CF)COCC([NH3+])=N2)n1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Cross-Family
Avg pChEMBL6.66
SourceBindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
O75874 IDH1 Homo sapiens Human PF00180 7.4 IC50 BindingDB
P56817 BACE1 Homo sapiens Human PF00026 6.6 IC50 BindingDB
Q9Y5Z0 BACE2 Homo sapiens Human PF00026 6.0 IC50 BindingDB