Molecule Details
InChIKeyPJWUUDRQACIYIH-UHFFFAOYSA-N
Compound Name3-methyl-6-[4-[2-oxo-2-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]ethoxy]phenyl]-1-propyl-5H-pyrrolo[3,2-d]pyrimidine-2,4-dione
Canonical SMILESCCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccc(C(F)(F)F)cc5)CC4)cc3)cc21
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL7.41
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P29275 ADORA2B Homo sapiens Human PF00001 8.7 Ki ChEMBL;BindingDB
P30542 ADORA1 Homo sapiens Human PF00001 7.0 Ki ChEMBL;BindingDB
P29274 ADORA2A Homo sapiens Human PF00001 6.5 Ki ChEMBL;BindingDB