Molecule Details
InChIKeyOMUDHMBLKINCCX-XXBNENTESA-N
Compound Name4-[4-methyl-5-[3-[(2R,3S)-2-[4-(trifluoromethyl)phenyl]-5-azaspiro[2.4]heptan-5-yl]propylsulfanyl]-1,2,4-triazol-3-yl]-3H-pyridin-2-one
Canonical SMILESCn1c(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)nnc1C1=CC=NC(=O)C1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL6.98
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P35462 DRD3 Homo sapiens Human PF00001 8.3 Ki ChEMBL;BindingDB
P11229 CHRM1 Homo sapiens Human PF00001 6.4 Ki ChEMBL;BindingDB
P20309 CHRM3 Homo sapiens Human PF00001 6.2 Ki ChEMBL;BindingDB