Molecule Details
InChIKeyQMBOMETUAPMBFM-HGVHAKBWSA-N
Compound Name(S)-2-[5-((R)-2-Amino-3-mercapto-propionylamino)-2-(4-fluoro-benzyl)-pentanoylamino]-4-methylsulfanyl-butyric acid
Canonical SMILESCSCC[C@H](NC(=O)C(CCCNC(=O)[C@@H](N)CS)Cc1ccc(F)cc1)C(=O)O
Clinical Status Clinical Multi-Target
Targets (Human+Pathogen)3
Pfam Stratification Cross-Family
Avg pChEMBL7.72
SourceChEMBL;TTD_MultiTarget
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P49354 FNTA Homo sapiens Human PF01239 8.1 pIC50 TTD_MultiTarget
P49356 FNTB Homo sapiens Human PF00432 8.1 IC50 ChEMBL
P53609 PGGT1B Homo sapiens Human PF00432 7.0 IC50 ChEMBL