Molecule Details
InChIKeyRVUJRRBCTAYDMG-UHFFFAOYSA-N
Compound Namebenzyl N-[1-[[1-[(5-hydroxy-1,3,3-trimethylcyclohexyl)methylamino]-1,2-dioxopentan-3-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamate
Canonical SMILESCCC(NC(=O)C(CC(C)C)NC(=O)OCc1ccccc1)C(=O)C(=O)NCC1(C)CC(O)CC(C)(C)C1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Cross-Family
Avg pChEMBL6.53
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P17655 CAPN2 Homo sapiens Human PF01067 PF13833 PF00648 7.2 Ki ChEMBL;BindingDB
P07384 CAPN1 Homo sapiens Human PF01067 PF13833 PF00648 6.4 Ki ChEMBL;BindingDB
P07858 CTSB Homo sapiens Human PF00112 PF08127 6.0 Ki ChEMBL;BindingDB