Molecule Details
InChIKeyYIDWZRRYJRXRPX-UHFFFAOYSA-N
Compound Name5-[5-Amino-7-(4-fluorophenyl)-2-[(3-fluoropyrid in-2-yl)methyl]-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl]-l-(propan-2-yl)-l,2-dihydropyridin-2-one
Canonical SMILESCC(C)n1cc(-c2c(-c3ccc(F)cc3)nc(N)n3nc(Cc4ncccc4F)nc23)ccc1=O
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL8.98
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P30542 ADORA1 Homo sapiens Human PF00001 10.0 IC50 ChEMBL;BindingDB
P29275 ADORA2B Homo sapiens Human PF00001 8.6 IC50 ChEMBL;BindingDB
P29274 ADORA2A Homo sapiens Human PF00001 8.4 IC50 ChEMBL;BindingDB