Molecule Details
InChIKeyNXBXTZDBNPJDJD-UHFFFAOYSA-N
Compound Name3-[[6-Amino-3,5-dicyano-4-(furan-2-yl)-2-pyridinyl]sulfanylmethyl]benzoic acid
Canonical SMILESN#Cc1c(N)nc(SCc2cccc(C(=O)O)c2)c(C#N)c1-c1ccco1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL6.95
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 8.4 Ki ChEMBL;BindingDB
P29274 ADORA2A Homo sapiens Human PF00001 6.2 Ki ChEMBL;BindingDB
P0DMS8 ADORA3 Homo sapiens Human PF00001 6.2 Ki ChEMBL;BindingDB