BDBM50296805 5-ethyl-2-(2-(4-(1-methylpiperidin-4-yl)piperazin-1-yl)pyridin-3-yl)-4H-benzo[d][1,3]oxazin-4-one::CHEMBL564055
SMILES: CCc1cccc2nc(oc(=O)c12)-c1cccnc1N1CCN(CC1)C1CCN(C)CC1
InChI Key: InChIKey=UKDHSIYUBSOPCS-UHFFFAOYSA-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)) | BDBM50296805 (5-ethyl-2-(2-(4-(1-methylpiperidin-4-yl)piperazin-...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 8.5 | n/a | n/a | n/a | n/a | n/a | n/a |
ActivX Biosciences, Inc Curated by ChEMBL | Assay Description Inhibition of human sputum neutrophil elastase by fluorescence based assay | Bioorg Med Chem Lett 19: 4743-6 (2009) Article DOI: 10.1016/j.bmcl.2009.06.053 BindingDB Entry DOI: 10.7270/Q2M32VT3 | |||||||||||
More data for this Ligand-Target Pair |