Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Glutathione S-transferase P/Serine/threonine-protein kinase/endoribonuclease IRE1' and Ligand = 'BDBM257160'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Glutathione S-transferase P/Serine/threonine-protein kinase/endoribonuclease IRE1 (Homo sapiens (Human))	BDBM257160 (US9493435, 182) Show SMILES OC(=O)c1ccc(Oc2ccc3c(C=O)c(O)ccc3c2)cc1 Show InChI InChI=1S/C18H12O5/c19-10-16-15-7-6-14(9-12(15)3-8-17(16)20)23-13-4-1-11(2-5-13)18(21)22/h1-10,20H,(H,21,22)	PDB UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	7.5	30
MannKing Corporation US Patent					Assay Description A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...				US Patent US9493435 (2016) BindingDB Entry DOI: 10.7270/Q29Z93TG
					More data for this Ligand-Target Pair