Molecule Details
InChIKeyBAPCHZCMISFSHS-UHFFFAOYSA-N
Compound NameUS20230293517, Example 9.9
Canonical SMILESCOC1(C#N)CCN(C(=O)Nc2nc(-c3cccc(C#N)c3)c(-c3cc(C)nc(CO)c3)s2)CC1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)4
Pfam Stratification Homologous
Avg pChEMBL7.91
SourceBindingDB
2D Structure
2D structure
Activity Profile
Target Activities (4)
Target Gene Organism Category Pfam pChEMBL Type Source
P29274 ADORA2A Homo sapiens Human PF00001 9.5 Ki BindingDB
P29275 ADORA2B Homo sapiens Human PF00001 8.5 Ki BindingDB
P30542 ADORA1 Homo sapiens Human PF00001 7.3 Ki BindingDB
P0DMS8 ADORA3 Homo sapiens Human PF00001 6.3 Ki BindingDB