Molecule Details
InChIKeyDOBNVUFHFMVMDB-BEFAXECRSA-N
Compound NameSacubitrilat
Canonical SMILESC[C@H](C[C@@H](Cc1ccc(-c2ccccc2)cc1)NC(=O)CCC(=O)O)C(=O)O
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)2
Pfam Stratification Cross-Family
Avg pChEMBL8.2
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
DrugBank Annotations
DrugBank ID DB14127
Drug NameSacubitrilat
CAS Number149709-44-4
Groups experimental
ATC Codes nan
DescriptionA metabolite of LCZ696 with neprilysin inhibitory activity.
Categories: Acids, Acyclic Amino Acids Amino Acids, Peptides, and Proteins Benzene Derivatives Butyrates Neprilysin Inhibitor Neprilysin Inhibitors
Cross-references: BindingDB: 50034842 CHEMBL417007 ChemSpider: 8605468 PDB: 6LD RxCUI: 1860608 Wikipedia: Sacubitrilat ZINC: ZINC000001536201
Target Activities (2)
Target Gene Organism Category Pfam pChEMBL Type Source
P08473 MME Homo sapiens Human PF01431 PF05649 8.2 IC50 ChEMBL;BindingDB
P12821 ACE Homo sapiens Human PF01401 8.2 Ki ChEMBL;BindingDB
DrugBank Target Actions (1)
Target Gene Target Name Action Type
P08473 MME Neprilysin inhibitor targets