BDBM50517470 CHEMBL4448798

SMILES: CS(=O)(=O)Nc1ccc(-c2ccc3OCOc3c2)c2cccnc12

InChI Key: InChIKey=WAXIWTSDZINAJK-UHFFFAOYSA-N

Data: 1 IC50

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 = 50517470   

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 I (Homo sapiens (Human))	BDBM50517470 (CHEMBL4448798) Show SMILES CS(=O)(=O)Nc1ccc(-c2ccc3OCOc3c2)c2cccnc12 Show InChI InChI=1S/C17H14N2O4S/c1-24(20,21)19-14-6-5-12(13-3-2-8-18-17(13)14)11-4-7-15-16(9-11)23-10-22-15/h2-9,19H,10H2,1H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.12E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition recombinant human N-terminal 6His-tagged GLO1 (2 to 184 residues) expressed in Escherichia coli using MG as substrate preincubated for 15 ...				J Med Chem 62: 1609-1625 (2019) Article DOI: 10.1021/acs.jmedchem.8b01868
					More data for this Ligand-Target Pair