Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50361690   

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-beta (Homo sapiens (Human))	BDBM50361690 (CHEMBL1940933) Show SMILES CCNC(=O)c1noc(c1NC(=O)[C@H]1CC[C@H](CN)CC1)-c1cc(C(C)C)c(O)cc1O |r,wU:16.17,wD:13.13,(5.35,-45.31,;3.81,-45.3,;3.04,-43.96,;1.5,-43.96,;.84,-42.57,;.63,-45.23,;1.15,-46.68,;-.07,-47.62,;-1.34,-46.74,;-.91,-45.27,;-1.85,-44.05,;-3.38,-44.02,;-4.18,-45.33,;-4.13,-42.67,;-3.33,-41.35,;-4.06,-40.01,;-5.6,-39.97,;-6.34,-38.61,;-7.88,-38.57,;-6.41,-41.28,;-5.67,-42.64,;-2.67,-47.52,;-4.01,-46.75,;-5.34,-47.52,;-6.67,-46.75,;-6.67,-45.21,;-8.01,-47.52,;-5.34,-49.07,;-6.67,-49.84,;-4.01,-49.84,;-2.67,-49.07,;-1.33,-49.83,)| Show InChI InChI=1S/C23H32N4O5/c1-4-25-23(31)20-19(26-22(30)14-7-5-13(11-24)6-8-14)21(32-27-20)16-9-15(12(2)3)17(28)10-18(16)29/h9-10,12-14,28-29H,4-8,11,24H2,1-3H3,(H,25,31)(H,26,30)/t13-,14-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Ferrara Curated by ChEMBL					Assay Description Binding affinity to Hsp90 after 4 hrs by fluorescence polarization assay				J Med Chem 54: 8592-604 (2011) Article DOI: 10.1021/jm201155e BindingDB Entry DOI: 10.7270/Q2QF8T9M
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