Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Heat shock factor protein 1' and Ligand = 'BDBM50234087'   

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 factor protein 1 (Homo sapiens (Human))	BDBM50234087 (CHEMBL4091297) Show SMILES Cc1ccc2cc(ccc2n1)C(=O)Nc1c(C)ccc(NC(=O)c2ccc3OCCOc3c2)c1C Show InChI InChI=1S/C28H25N3O4/c1-16-4-9-22(30-27(32)21-8-11-24-25(15-21)35-13-12-34-24)18(3)26(16)31-28(33)20-7-10-23-19(14-20)6-5-17(2)29-23/h4-11,14-15H,12-13H2,1-3H3,(H,30,32)(H,31,33)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Inhibition of 17-AAG-induced HSF1 pathway in human SKOV3 cells assessed as reduction in HSP72 induction preincubated for 1 hr followed by 17-AAG addi...				J Med Chem 60: 180-201 (2017) Article DOI: 10.1021/acs.jmedchem.6b01055 BindingDB Entry DOI: 10.7270/Q2KW5J9D
					More data for this Ligand-Target Pair
Heat shock factor protein 1 (Homo sapiens (Human))	BDBM50234087 (CHEMBL4091297) Show SMILES Cc1ccc2cc(ccc2n1)C(=O)Nc1c(C)ccc(NC(=O)c2ccc3OCCOc3c2)c1C Show InChI InChI=1S/C28H25N3O4/c1-16-4-9-22(30-27(32)21-8-11-24-25(15-21)35-13-12-34-24)18(3)26(16)31-28(33)20-7-10-23-19(14-20)6-5-17(2)29-23/h4-11,14-15H,12-13H2,1-3H3,(H,30,32)(H,31,33)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Inhibition of 17-AAG-induced HSF1 pathway in human SKOV3 cells assessed as reduction in HSP72 induction preincubated for 1 hr followed by 17-AAG addi...				J Med Chem 60: 180-201 (2017) Article DOI: 10.1021/acs.jmedchem.6b01055 BindingDB Entry DOI: 10.7270/Q2KW5J9D
					More data for this Ligand-Target Pair