Molecule Details
InChIKeyPNKICJSNJYXQOE-OWCLPIDISA-N
Compound Name(2R)-N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-2-[(2S)-2-hydroxy-3-sulfanylpropyl]nonanamide
Canonical SMILESCCCCCCC[C@H](C[C@H](O)CS)C(=O)N[C@H](C(=O)NC)C(C)(C)C
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL8.73
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P14780 MMP9 Homo sapiens Human PF00040 PF00045 PF00413 9.8 IC50 ChEMBL;BindingDB
P03956 MMP1 Homo sapiens Human PF00045 PF00413 PF01471 8.3 IC50 ChEMBL;BindingDB
P08254 MMP3 Homo sapiens Human PF00045 PF00413 PF01471 8.1 IC50 ChEMBL;BindingDB