BDBM50286304 (R)-3-[(S)-2-((S)-2-Benzyloxycarbonylamino-3-methyl-butyrylamino)-propionylamino]-4-oxo-butyric acid::CHEMBL108082
SMILES: CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@H](CC(O)=O)C=O
InChI Key: InChIKey=YYQWNJQKDSNAES-LXZKKBNFSA-N
Data: 1 KI
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Caspase-1 (Homo sapiens (Human)) | BDBM50286304 ((R)-3-[(S)-2-((S)-2-Benzyloxycarbonylamino-3-methy...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article | 15 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Binding affinity against IL-1 beta converting enzyme | Bioorg Med Chem Lett 5: 315-318 (1995) Article DOI: 10.1016/0960-894X(95)00027-Q BindingDB Entry DOI: 10.7270/Q2668D5S | |||||||||||
More data for this Ligand-Target Pair |