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BDBM15407 4-tert-butyl-N-[4-hydroxy-3-(2-hydroxynaphthalen-1-yl)phenyl]benzene-1-sulfonamide::naphthol compound 10

SMILES: CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(O)c(c1)-c1c(O)ccc2ccccc12

InChI Key: InChIKey=SGKOJFCMFILPCL-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 15407   
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))
BDBM15407
PNG
(4-tert-butyl-N-[4-hydroxy-3-(2-hydroxynaphthalen-1...)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(O)c(c1)-c1c(O)ccc2ccccc12 |(3.57,11.38,;2.23,10.61,;3,9.27,;1.46,11.94,;.9,9.84,;-.43,10.61,;-1.77,9.84,;-1.77,8.3,;-.43,7.53,;.9,8.3,;-3.1,7.53,;-3.87,8.86,;-2.33,6.19,;-4.43,6.76,;-4.43,5.22,;-5.77,4.45,;-5.77,2.9,;-4.43,2.13,;-4.43,.59,;-3.1,2.9,;-3.1,4.45,;-1.77,2.13,;-1.77,.59,;-3.1,-.18,;-.43,-.18,;.9,.59,;.9,2.13,;2.23,2.91,;2.23,4.45,;.9,5.22,;-.43,4.45,;-.43,2.91,)|
Show InChI InChI=1S/C26H25NO4S/c1-26(2,3)18-9-12-20(13-10-18)32(30,31)27-19-11-15-23(28)22(16-19)25-21-7-5-4-6-17(21)8-14-24(25)29/h4-16,27-29H,1-3H3
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MMDB

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Similars

Article
PubMed
n/an/a 2.64E+4n/an/an/an/a7.422



Vernalis (R&D) Ltd



Assay Description
The assay is based upon displacement of a fluorescently labeled molecule, which binds specifically to the ATP-binding site of full-length human Hsp90...


Bioorg Med Chem Lett 15: 5187-91 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.092
BindingDB Entry DOI: 10.7270/Q2HH6H9Z
More data for this
Ligand-Target Pair