Molecule Details
InChIKeyMVXQUGZXCXZXGN-NQWXTVAOSA-N
Compound Name(1S,2R,3S,4R,5S)-4-[2-chloro-6-(dicyclopropylmethylamino)purin-9-yl]-1-(methylsulfanylmethyl)bicyclo[3.1.0]hexane-2,3-diol
Canonical SMILESCSC[C@@]12C[C@@H]1[C@@H](n1cnc3c(NC(C4CC4)C4CC4)nc(Cl)nc31)[C@H](O)[C@@H]2O
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)4
Pfam Stratification Homologous
Avg pChEMBL6.75
SourceChEMBL
2D Structure
2D structure
Activity Profile
Target Activities (4)
Target Gene Organism Category Pfam pChEMBL Type Source
P41595 HTR2B Homo sapiens Human PF00001 7.6 Ki ChEMBL
P30542 ADORA1 Homo sapiens Human PF00001 7.2 Ki ChEMBL
P28335 HTR2C Homo sapiens Human PF00001 6.1 Ki ChEMBL
P0DMS8 ADORA3 Homo sapiens Human PF00001 6.0 Ki ChEMBL