Molecule Details
InChIKeyJMEHHVKPUQMNOZ-UHFFFAOYSA-N
Compound Name8-(4-hydroxybicyclo[2.2.2]octan-1-yl)-1,3-dipropyl-1H-purine-2,6(3H,7H)-dione
Canonical SMILESCCCn1c(=O)c2nc(C34CCC(O)(CC3)CC4)[nH]c2n(CCC)c1=O
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL7.11
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 8.7 Ki ChEMBL;BindingDB
P29275 ADORA2B Homo sapiens Human PF00001 6.4 Ki ChEMBL;BindingDB
P29274 ADORA2A Homo sapiens Human PF00001 6.3 Ki ChEMBL;BindingDB