Molecule Details
InChIKeyLMDJIXVWEXHGAT-UHFFFAOYSA-N
Compound Name13-Propoxy-3,5-dipropyl-3,5,8,11-tetrazatricyclo[7.4.0.02,7]trideca-1(13),2(7),9,11-tetraene-4,6-dione
Canonical SMILESCCCOc1cncc2[nH]c3c(=O)n(CCC)c(=O)n(CCC)c3c12
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL7.22
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 8.4 Ki ChEMBL;BindingDB
P29274 ADORA2A Homo sapiens Human PF00001 6.8 Ki ChEMBL;BindingDB
P30542 ADORA1 Homo sapiens Human PF00001 6.5 Ki ChEMBL;BindingDB