Molecule Details
InChIKeyJXCFHCFAYKJVSI-UQJFVLDMSA-N
Compound Name(2S)-12-oxo-11-[[(2R)-3-phenyl-2-sulfanylpropanoyl]amino]-1-azatricyclo[6.4.1.04,13]trideca-4,6,8(13)-triene-2-carboxylic acid
Canonical SMILESO=C(NC1CCc2cccc3c2N(C1=O)[C@H](C(=O)O)C3)[C@H](S)Cc1ccccc1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Cross-Family
Avg pChEMBL6.73
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P08473 MME Homo sapiens Human PF01431 PF05649 7.1 IC50 ChEMBL;BindingDB
P12821 ACE Homo sapiens Human PF01401 6.5 IC50 ChEMBL
Q9BYF1 ACE2 Homo sapiens Human PF16959 PF01401 6.5 IC50 ChEMBL;BindingDB