Molecule Details
InChIKeyJQEQULOLEPTBRS-UHFFFAOYSA-N
Compound Name8-[3-[[4-methyl-5-(2-methylquinolin-5-yl)-1,2,4-triazol-3-yl]sulfanyl]propyl]-6,7,9,10-tetrahydro-4H-[1,4]oxazino[2,3-h][3]benzazepin-3-one
Canonical SMILESCc1ccc2c(-c3nnc(SCCCN4CCc5cc6c(cc5CC4)OCC(=O)N6)n3C)cccc2n1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Cross-Family
Avg pChEMBL7.2
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
Q12809 KCNH2 Homo sapiens Human PF00027 PF00520 PF13426 8.2 IC50 ChEMBL;BindingDB
P35367 HRH1 Homo sapiens Human PF00001 6.8 Ki ChEMBL;BindingDB
P35462 DRD3 Homo sapiens Human PF00001 6.6 Ki ChEMBL;BindingDB