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SMILES: CCNC(=O)c1noc(c1NC(=O)c1ccc(cc1)-n1cccc1)-c1cc(C(C)C)c(O)cc1O

InChI Key: InChIKey=YPTCAPKUIWGGHD-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50361709   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Heat shock protein HSP 90-beta


(Homo sapiens (Human))		BDBM50361709
PNG
(CHEMBL1941058)
Show SMILES CCNC(=O)c1noc(c1NC(=O)c1ccc(cc1)-n1cccc1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C26H26N4O5/c1-4-27-26(34)23-22(24(35-29-23)19-13-18(15(2)3)20(31)14-21(19)32)28-25(33)16-7-9-17(10-8-16)30-11-5-6-12-30/h5-15,31-32H,4H2,1-3H3,(H,27,34)(H,28,33)
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n/an/a 32n/an/an/an/an/an/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
More data for this
Ligand-Target Pair