Molecule Details
InChIKeyMXSCITZYHDRLLP-XNIJJKJLSA-N
Compound Name[[(2R,3S,4R,5R)-5-(6-anilinopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
Canonical SMILESO=P(O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(Nc4ccccc4)ncnc32)[C@H](O)[C@@H]1O
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL7.07
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
Q9UBL9 P2RX2 Homo sapiens Human PF00864 8.4 IC50 ChEMBL;BindingDB
P56373 P2RX3 Homo sapiens Human PF00864 6.7 IC50 ChEMBL;BindingDB
Q99571 P2RX4 Homo sapiens Human PF00864 6.0 IC50 ChEMBL;BindingDB