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SMILES: Brc1ccccc1-c1nnc(CSc2nc3ccccc3c(=O)n2Cc2ccco2)o1

InChI Key: InChIKey=KBUQWKKMMAIIRE-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 71736   
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 factor protein 1


(Mus musculus)		BDBM71736
PNG
(2-[[5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]methyls...)
Show SMILES Brc1ccccc1-c1nnc(CSc2nc3ccccc3c(=O)n2Cc2ccco2)o1
Show InChI InChI=1S/C22H15BrN4O3S/c23-17-9-3-1-7-15(17)20-26-25-19(30-20)13-31-22-24-18-10-4-2-8-16(18)21(28)27(22)12-14-6-5-11-29-14/h1-11H,12-13H2
PDB

KEGG

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PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a>2.60E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Confirmation testing of small molecules identifie...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2P55KXK
More data for this
Ligand-Target Pair