null

SMILES: Cc1nsc(NC(=O)c2cc(Sc3nncn3C)ccc2N)n1

InChI Key: InChIKey=AZMDKDLMECFFMX-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50248444   

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
Hexokinase-4 (Homo sapiens (Human))	BDBM50248444 (2-amino-N-(3-methyl-1,2,4-thiadiazol-5-yl)-5-(4-me...) Show SMILES Cc1nsc(NC(=O)c2cc(Sc3nncn3C)ccc2N)n1 Show InChI InChI=1S/C13H13N7OS2/c1-7-16-12(23-19-7)17-11(21)9-5-8(3-4-10(9)14)22-13-18-15-6-20(13)2/h3-6H,14H2,1-2H3,(H,16,17,19,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	180	n/a	n/a	n/a	n/a
Banyu Tsukuba Research Institute Curated by ChEMBL					Assay Description Activation of human glucokinase by glucose-6-phosphate dehydrogenase coupled continuous spectrophotometric assay in presence of 10 mM glucose				Bioorg Med Chem Lett 19: 1357-60 (2009) Article DOI: 10.1016/j.bmcl.2009.01.053 BindingDB Entry DOI: 10.7270/Q2PC3285
					More data for this Ligand-Target Pair
Hexokinase-4 (Homo sapiens (Human))	BDBM50248444 (2-amino-N-(3-methyl-1,2,4-thiadiazol-5-yl)-5-(4-me...) Show SMILES Cc1nsc(NC(=O)c2cc(Sc3nncn3C)ccc2N)n1 Show InChI InChI=1S/C13H13N7OS2/c1-7-16-12(23-19-7)17-11(21)9-5-8(3-4-10(9)14)22-13-18-15-6-20(13)2/h3-6H,14H2,1-2H3,(H,16,17,19,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	640	n/a	n/a	n/a	n/a
Banyu Tsukuba Research Institute Curated by ChEMBL					Assay Description Activation of human glucokinase by glucose-6-phosphate dehydrogenase coupled continuous spectrophotometric assay in presence of 2.5 mM glucose				Bioorg Med Chem Lett 19: 1357-60 (2009) Article DOI: 10.1016/j.bmcl.2009.01.053 BindingDB Entry DOI: 10.7270/Q2PC3285
					More data for this Ligand-Target Pair