Molecule Details
InChIKeyQCDCMDPVHPUROA-UHFFFAOYSA-N
Compound NameN-(3-((1H-pyrazol-3-yl)methyl)-2,3,4,5-tetrahydro-1H-benzo[d]azepin-7-yl)-4-butylbenzenesulfonamide
Canonical SMILESCCCCc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN(Cc2cc[nH]n2)CC3)cc1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)4
Pfam Stratification Cross-Family
Avg pChEMBL6.93
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (4)
Target Gene Organism Category Pfam pChEMBL Type Source
P35462 DRD3 Homo sapiens Human PF00001 8.4 Ki ChEMBL
P14416 DRD2 Homo sapiens Human PF00001 7.0 Ki ChEMBL
P11712 CYP2C9 Homo sapiens Human PF00067 6.2 IC50 ChEMBL;BindingDB
P08684 CYP3A4 Homo sapiens Human PF00067 6.1 IC50 ChEMBL;BindingDB