Molecule Details
InChIKeyYTSWRFHHGNPXRN-UHFFFAOYSA-N
Compound Name3-((2-(3,6-dihydro-2H-thiopyran-4-yl)ethylamino)methyl)-N,N-dimethyl-3,4-dihydro-2H-benzo[b][1,4]dioxepin-3-amine
Canonical SMILESCN(C)C1(CNCCC2=CCSCC2)COc2ccccc2OC1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL7.67
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P20309 CHRM3 Homo sapiens Human PF00001 8.2 Ki ChEMBL;BindingDB
P08172 CHRM2 Homo sapiens Human PF00001 7.9 Ki ChEMBL;BindingDB
P11229 CHRM1 Homo sapiens Human PF00001 6.8 Ki ChEMBL;BindingDB