Molecule Details
InChIKeyIITBTBZPEPWWLP-UHFFFAOYSA-N
Compound Name1-[(4-Octoxyphenyl)methyl]azetidine-3-carboxylic acid
Canonical SMILESCCCCCCCCOc1ccc(CN2CC(C(=O)O)C2)cc1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL7.9
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P21453 S1PR1 Homo sapiens Human PF00001 8.7 IC50 ChEMBL;BindingDB
Q9H228 S1PR5 Homo sapiens Human PF00001 8.3 IC50 ChEMBL;BindingDB
Q99500 S1PR3 Homo sapiens Human PF00001 6.7 IC50 ChEMBL;BindingDB