Molecule Details
InChIKeyYMDHLHZVVIBPIA-UHFFFAOYSA-N
Compound NameN-(cyanomethyl)-4-methyl-2-{3-[4-(1,2,3,6-tetrahydropyridin-4-yl)phenyl]phenyl}pentanamide
Canonical SMILESCC(C)CC(C(=O)NCC#N)c1cccc(-c2ccc(C3=CCNCC3)cc2)c1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL6.56
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P43235 CTSK Homo sapiens Human PF08246 PF00112 7.2 IC50 ChEMBL;BindingDB
P07858 CTSB Homo sapiens Human PF00112 PF08127 6.3 IC50 ChEMBL;BindingDB
P25774 CTSS Homo sapiens Human PF08246 PF00112 6.2 IC50 ChEMBL;BindingDB