Molecule Details
InChIKeyWEIPLKPBHPNHCD-JIUQEAKESA-N
Canonical SMILESC[C@@](CO)(NCc1cc(Cl)c(O[C@H]2CCc3c(-c4cccc5c4CC[C@@H]5Oc4nc(OCc5cncc(S(C)(=O)=O)c5)c(CN[C@@](C)(CO)C(=O)O)cc4Cl)cccc32)nc1OCc1cncc(S(C)(=O)=O)c1)C(=O)O
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)2
Pfam Stratification Homologous
Avg pChEMBL10.24
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (2)
Target Gene Organism Category Pfam pChEMBL Type Source
Q15116 PDCD1 Homo sapiens Human PF07686 10.2 IC50 ChEMBL
Q9NZQ7 CD274 Homo sapiens Human PF08205 PF07686 10.2 IC50 ChEMBL;BindingDB