Molecule Details
InChIKeyBMJOPMWNNPSOFV-IHGGYBGLSA-N
Compound Namebenzyl N-[1-[[1-[2-[5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]ethylamino]-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)NCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)2
Pfam Stratification Homologous
Avg pChEMBL6.37
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (2)
Target Gene Organism Category Pfam pChEMBL Type Source
P17655 CAPN2 Homo sapiens Human PF01067 PF13833 PF00648 6.5 Ki ChEMBL;BindingDB
P07384 CAPN1 Homo sapiens Human PF01067 PF13833 PF00648 6.2 Ki ChEMBL;BindingDB