BDBM50104586 CHEMBL316418::[(R)-1-((S)-1-Benzyl-2-benzyloxycarbamoyl-2-oxo-ethylcarbamoyl)-2-methyl-propyl]-carbamic acid benzyl ester
SMILES: CC(C)[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)C(=O)NOCc1ccccc1
InChI Key: InChIKey=CCGXVCBAIJHVTN-IZZNHLLZSA-N
Data: 1 IC50
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
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Calpain1 (Homo sapiens (Human)) | BDBM50104586 (CHEMBL316418 | [(R)-1-((S)-1-Benzyl-2-benzyloxycar...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc. Curated by ChEMBL | Assay Description Inhibition of human recombinant Calpain 1 | Bioorg Med Chem Lett 11: 2615-7 (2001) BindingDB Entry DOI: 10.7270/Q2J38RVZ | |||||||||||
More data for this Ligand-Target Pair |