BDBM50336253 5-hydroxy-7-(5-(hydroxymethyl)furan-2-yl)-1-(4-methoxyphenyl)hepta-1,4,6-trien-3-one::CHEMBL488901

SMILES: COc1ccc(C=CC(=O)CC(=O)C=Cc2ccc(CO)o2)cc1

InChI Key: InChIKey=MYPWTQWJYCUBKG-UHFFFAOYSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50336253   

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
Glyoxalase 1 (GLO1) (Homo sapiens (Human))	BDBM50336253 (5-hydroxy-7-(5-(hydroxymethyl)furan-2-yl)-1-(4-met...) Show SMILES COc1ccc(C=CC(=O)CC(=O)C=Cc2ccc(CO)o2)cc1 |w:14.14,7.7| Show InChI InChI=1S/C19H18O5/c1-23-17-7-3-14(4-8-17)2-5-15(21)12-16(22)6-9-18-10-11-19(13-20)24-18/h2-11,20H,12-13H2,1H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	7.40E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of human recombinant His-tagged glyoxalase 1 expressed in Escherichia coli BL21 (DE3) preincubated for 20 mins by Dixon plot analysis				Bioorg Med Chem 19: 1189-96 (2011) Article DOI: 10.1016/j.bmc.2010.12.039 BindingDB Entry DOI: 10.7270/Q2222V2X
					More data for this Ligand-Target Pair