Molecule Details
InChIKeyLDISRPMCMZFMTM-QHCPKHFHSA-N
Compound Name5-[(2R)-11-(4-amino-4-methylpiperidin-1-yl)-4,7,10-triazatricyclo[7.4.0.02,7]trideca-1(9),10,12-trien-4-yl]quinoline-8-carbonitrile
Canonical SMILESCC1(N)CCN(c2ccc3c(n2)CN2CCN(c4ccc(C#N)c5ncccc45)C[C@@H]32)CC1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL8.01
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
Q9NR97 TLR8 Homo sapiens Human PF13855 PF01582 8.7 IC50 ChEMBL;BindingDB
Q9NYK1 TLR7 Homo sapiens Human PF13855 PF01582 8.1 IC50 ChEMBL;BindingDB
Q9NR96 TLR9 Homo sapiens Human PF18837 PF13516 PF13855 PF01582 7.2 IC50 ChEMBL;BindingDB