Molecule Details
InChIKeyUUDKVUOONJCNHM-AEISUSGSSA-N
Compound Name(2S,3S,4R,5R)-5-(2-chloro-6-(cyclopropylamino)-9H-purin-9-yl)-N-ethyl-3,4-dihydroxy-tetrahydrothiophene-2-carboxamide
Canonical SMILESCCNC(=O)[C@H]1S[C@@H](n2cnc3c(NC4CC4)nc(Cl)nc32)[C@H](O)[C@@H]1O
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL7.96
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P0DMS8 ADORA3 Homo sapiens Human PF00001 9.2 Ki ChEMBL;BindingDB
P30542 ADORA1 Homo sapiens Human PF00001 8.5 Ki ChEMBL;BindingDB
P29274 ADORA2A Homo sapiens Human PF00001 6.2 Ki ChEMBL;BindingDB