BDBM50517481 CHEMBL4440697

SMILES: O=S(=O)(Nc1cccc2cccnc12)c1ccc2ncsc2c1

InChI Key: InChIKey=APWTVSAYJSUBCS-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 = 50517481   

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))	BDBM50517481 (CHEMBL4440697) Show SMILES O=S(=O)(Nc1cccc2cccnc12)c1ccc2ncsc2c1 Show InChI InChI=1S/C16H11N3O2S2/c20-23(21,12-6-7-13-15(9-12)22-10-18-13)19-14-5-1-3-11-4-2-8-17-16(11)14/h1-10,19H	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.90E+3	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