Molecule Details
InChIKeyMNURXUBONYMHGW-XVTZWQNCSA-N
Compound NameUS11472811, Example 48B
Canonical SMILESC[C@](C(=O)N[C@@H]1CCC[C@@H]1O)(c1ccccc1)n1ncc2c1nc(N)n1nc(-c3ccco3)nc21
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Cross-Family
Avg pChEMBL8.46
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P00813 ADA Homo sapiens Human PF00962 8.8 IC50 ChEMBL;BindingDB
P29274 ADORA2A Homo sapiens Human PF00001 8.7 Ki ChEMBL;BindingDB
P30542 ADORA1 Homo sapiens Human PF00001 7.9 Ki ChEMBL;BindingDB