Molecule Details
InChIKeyRGINHWLPKMMZFM-HNRLDMCXSA-N
Compound Name(E,3S)-3-[[(2S)-1-[(2S)-2-[[(2S)-3-carboxy-2-(phenylmethoxycarbonylamino)propanoyl]amino]-3,3-dimethylbutanoyl]azetidine-2-carbonyl]amino]-5-methylsulfonylpent-4-enoic acid
Canonical SMILESCC(C)(C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)OCc1ccccc1)C(=O)N1CC[C@H]1C(=O)N[C@H](/C=C/S(C)(=O)=O)CC(=O)O
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL6.41
SourceChEMBL
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P42574 CASP3 Homo sapiens Human PF00656 6.5 IC50 ChEMBL
Q92851 CASP10 Homo sapiens Human PF01335 PF00656 6.4 IC50 ChEMBL
P55210 CASP7 Homo sapiens Human PF00656 6.3 IC50 ChEMBL