Molecule Details
InChIKeyNBEARLDWGIZSTM-UHFFFAOYSA-N
Compound NameN-(4-benzyl-1-methylpiperidin-4-yl)-2-cyano-4-(spiro[2.5]octan-6-ylmethylamino)pyrimidine-5-carboxamide
Canonical SMILESCN1CCC(Cc2ccccc2)(NC(=O)c2cnc(C#N)nc2NCC2CCC3(CC2)CC3)CC1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL7.43
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P25774 CTSS Homo sapiens Human PF08246 PF00112 8.7 IC50 ChEMBL;BindingDB
P43235 CTSK Homo sapiens Human PF08246 PF00112 6.8 IC50 ChEMBL;BindingDB
P07711 CTSL Homo sapiens Human PF08246 PF00112 6.7 IC50 ChEMBL;BindingDB