Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Heat shock protein HSP 90-alpha' and Ligand = 'BDBM50429457'   

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))	BDBM50429457 (Argenteoside A | CHEMBL2332352) Show SMILES OC[C@H]1O[C@@H](O[C@@H]2OC=C[C@H]3[C@H](OC(=O)[C@H]4[C@@H]([C@H]([C@@H]4c4ccc(O)cc4)c4ccc(O)cc4)C(=O)O[C@@H]4[C@@H]5O[C@]5(CO)[C@@H]5[C@H]4C=CO[C@H]5O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]4O[C@]4(CO)[C@@H]23)[C@H](O)[C@@H](O)[C@@H]1O |r,c:8,49| Show InChI InChI=1S/C48H56O24/c49-13-23-31(55)33(57)35(59)45(65-23)69-43-29-21(9-11-63-43)37(39-47(29,15-51)71-39)67-41(61)27-25(17-1-5-19(53)6-2-17)26(18-3-7-20(54)8-4-18)28(27)42(62)68-38-22-10-12-64-44(30(22)48(16-52)40(38)72-48)70-46-36(60)34(58)32(56)24(14-50)66-46/h1-12,21-40,43-46,49-60H,13-16H2/t21-,22-,23-,24-,25+,26+,27-,28-,29-,30-,31-,32-,33+,34+,35-,36-,37+,38+,39+,40+,43+,44+,45+,46+,47-,48-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a
Universit£ di Salerno Curated by ChEMBL					Assay Description Binding affinity to recombinant Hsp90 alpha (unknown origin) by surface plasmon resonance				J Med Chem 56: 1583-95 (2013) Article DOI: 10.1021/jm301398y BindingDB Entry DOI: 10.7270/Q2K938W3
					More data for this Ligand-Target Pair