BDBM222268 2-Methyl-4-(2-oxo-2-phenyl-ethyl)-5-phenyl-furan-3-carboxylic acid methyl ester (3a)
SMILES: COC(=O)c1c(C)oc(c1CC(=O)c1ccccc1)-c1ccccc1
InChI Key: InChIKey=PZVNYSHTJCIIHV-UHFFFAOYSA-N
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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Lipoxygenase (SLO) (Glycine max (Soybean)) | BDBM222268 (2-Methyl-4-(2-oxo-2-phenyl-ethyl)-5-phenyl-furan-3...) | PDB UniProtKB/TrEMBL GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | 662 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
CSIR - Indian Institute of Chemical Biology | Assay Description The crystal structure of soybean lipoxygenase-1 (PDB code: 3PZW), was used in our docking experiments. The 3D structure of 3PZW was reported by Chrus... | Bioorg Chem 71: 97-101 (2017) Article DOI: 10.1016/j.bioorg.2017.01.016 BindingDB Entry DOI: 10.7270/Q2F76BCD | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Lipoxygenase-1 (Glycine max (soybean)) | BDBM222268 (2-Methyl-4-(2-oxo-2-phenyl-ethyl)-5-phenyl-furan-3...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | 7.85E+4 | n/a | n/a | n/a | n/a | 8.0 | n/a |
CSIR - Indian Institute of Chemical Biology | Assay Description SLO inhibition was studied by spectrophotometric assay by measuring the change in the absorbance at 234 nm due to formation of hydroperoxylinoleic ac... | Bioorg Chem 71: 97-101 (2017) Article DOI: 10.1016/j.bioorg.2017.01.016 BindingDB Entry DOI: 10.7270/Q2F76BCD | |||||||||||
More data for this Ligand-Target Pair |