Molecule Details
InChIKeyBMHZAHGTGIZZCT-UHFFFAOYSA-N
Compound NameMinalrestat
Canonical SMILESO=C1CC2(C(=O)N1)C(=O)N(Cc1ccc(Br)cc1F)C(=O)c1ccc(F)cc12
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL7.3
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P14550 AKR1A1 Homo sapiens Human PF00248 8.2 IC50 ChEMBL
P15121 AKR1B1 Homo sapiens Human PF00248 7.6 IC50 ChEMBL;BindingDB
O60218 AKR1B10 Homo sapiens Human PF00248 6.1 IC50 ChEMBL