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BDBM50455686 CHEMBL3906699

SMILES: CN(Cc1cccc(C)c1)C(=O)c1cc(-c2n[nH]c(=O)n2-c2ccccc2C)c(O)cc1O

InChI Key: InChIKey=CHUFPYKTZKSLIM-UHFFFAOYSA-N

Data: 1 Kd

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50455686   
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 90 (Hsp90)


(Homo sapiens (Human))
BDBM50455686
PNG
(CHEMBL3906699)
Show SMILES CN(Cc1cccc(C)c1)C(=O)c1cc(-c2n[nH]c(=O)n2-c2ccccc2C)c(O)cc1O
Show InChI InChI=1S/C13H14N2O3S2.ClH/c1-15-7-9-2-4-10(5-3-9)13(16)11-6-12(19-8-11)20(14,17)18;/h2-6,8,15H,7H2,1H3,(H2,14,17,18);1H
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Similars

Article
PubMed
n/an/an/a 5.5n/an/an/an/an/a



University of Vienna

Curated by ChEMBL


Assay Description
Binding affinity to recombinant N-terminal Hsp90 (unknown origin) by SPR method


J Med Chem 61: 4397-4411 (2018)


Article DOI: null
BindingDB Entry DOI: 10.7270/Q2G163FN
More data for this
Ligand-Target Pair