Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Heat shock protein HSP 90-alpha' and Ligand = 'BDBM50276629'   

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
Heat shock protein HSP 90-alpha (Homo sapiens (Human))	BDBM50276629 (2-chloro-4-(5-(4-ethoxyphenyl)-1,2,3-thiadiazol-4-...) Show SMILES CCOc1ccc(cc1)-c1snnc1-c1cc(CC)c(O)c(Cl)c1O Show InChI InChI=1S/C18H17ClN2O3S/c1-3-10-9-13(17(23)14(19)16(10)22)15-18(25-21-20-15)11-5-7-12(8-6-11)24-4-2/h5-9,22-23H,3-4H2,1-2H3	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	>2.00E+4	n/a	n/a	n/a	n/a	n/a
Fermentas UAB Curated by ChEMBL					Assay Description Binding affinity to human full length Histidine6-tagged Hsp90alpha expressed in Escherichia coli BL21 DE3 by ITC				Bioorg Med Chem Lett 19: 1089-92 (2009) Article DOI: 10.1016/j.bmcl.2009.01.003 BindingDB Entry DOI: 10.7270/Q27944KP
					More data for this Ligand-Target Pair