Molecule Details
InChIKeyRJUXWBNDZWRQEF-YOAIMQRKSA-N
Compound Name(1S,3aR,6aS)-2-((S)-3-Methyl-2-{(S)-3-methyl-2-[(pyrazine-2-carbonyl)-amino]-butyrylamino}-butyryl)-octahydro-cyclopenta[c]pyrrole-1-carboxylic acid (1-cyclopropylaminooxalyl-butyl)-amide
Canonical SMILESCCCC(NC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)c1cnccn1)C(C)C)C(C)C)C(=O)C(=O)NC1CC1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL7.5
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P07858 CTSB Homo sapiens Human PF00112 PF08127 8.4 Ki ChEMBL;BindingDB
P07711 CTSL Homo sapiens Human PF08246 PF00112 7.9 Ki ChEMBL;BindingDB
P43235 CTSK Homo sapiens Human PF08246 PF00112 6.2 Ki ChEMBL;BindingDB