BDBM50284224 6-Methoxy-9-pyridin-2-ylmethyl-1,9-dihydro-[1,3]oxazino[4,5-b]indole-2,4-dione::CHEMBL354406
SMILES: COc1ccc2n(Cc3ccccn3)c3nc(=O)oc(O)c3c2c1
InChI Key: InChIKey=ZXVRTHNEVCBHPW-UHFFFAOYSA-N
Data: 2 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Alpha-chymotrypsin (Bos taurus (bovine)) | BDBM50284224 (6-Methoxy-9-pyridin-2-ylmethyl-1,9-dihydro-[1,3]ox...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article | n/a | n/a | 5.12E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Inhibitory activity of the compound against chymotrypsin using Suc-Ala-Ala-Pro-Phe-pNA (416 uM) as substrate | Bioorg Med Chem Lett 4: 949-954 (1994) Article DOI: 10.1016/S0960-894X(01)80270-5 BindingDB Entry DOI: 10.7270/Q27W6C4C | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Leukocyte elastase (Homo sapiens (Human)) | BDBM50284224 (6-Methoxy-9-pyridin-2-ylmethyl-1,9-dihydro-[1,3]ox...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article | n/a | n/a | >1.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description In vitro inhibition of human leukocyte elastase. | Bioorg Med Chem Lett 4: 949-954 (1994) Article DOI: 10.1016/S0960-894X(01)80270-5 BindingDB Entry DOI: 10.7270/Q27W6C4C | |||||||||||
More data for this Ligand-Target Pair |