BDBM50305816 6-O-Z-pcoumaroyl scandoside methyl ester::CHEMBL499411::Z-6-O-p-coumaroyl scandoside methyl ester
SMILES: COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1[C@H](OC(=O)\C=C/c1ccc(O)cc1)C=C2CO
InChI Key: InChIKey=ABYPZHZWILXERF-HVZPATBJSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Leukocyte elastase (Homo sapiens (Human)) | BDBM50305816 (6-O-Z-pcoumaroyl scandoside methyl ester | CHEMBL4...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL KEGG PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Korea Research Institute of Bioscience and Biotechnology Curated by ChEMBL | Assay Description Inhibition of human neutrophil elastase | Bioorg Med Chem Lett 20: 513-5 (2010) Article DOI: 10.1016/j.bmcl.2009.11.109 BindingDB Entry DOI: 10.7270/Q2TB170S | |||||||||||
More data for this Ligand-Target Pair |