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BDBM71948 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-4-(3,4,5-trimethoxyphenyl)-1H-pyrazol-3-amine::1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-4-(3,4,5-trimethoxyphenyl)-3-pyrazolamine::1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-4-(3,4,5-trimethoxyphenyl)pyrazol-3-amine::MLS000531238::SMR000136218::[1-piazthiol-4-ylsulfonyl-4-(3,4,5-trimethoxyphenyl)pyrazol-3-yl]amine::cid_2223423

SMILES: COc1cc(cc(OC)c1OC)-c1cn(nc1N)S(=O)(=O)c1cccc2nsnc12

InChI Key: InChIKey=XLUPUMSSTNDXAY-UHFFFAOYSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 71948   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Hsf1 protein


(Mus musculus)
BDBM71948
PNG
(1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-4-(3,4,5-tr...)
Show SMILES COc1cc(cc(OC)c1OC)-c1cn(nc1N)S(=O)(=O)c1cccc2nsnc12
Show InChI InChI=1S/C18H17N5O5S2/c1-26-13-7-10(8-14(27-2)17(13)28-3)11-9-23(20-18(11)19)30(24,25)15-6-4-5-12-16(15)22-29-21-12/h4-9H,1-3H3,(H2,19,20)
PDB

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KEGG

UniProtKB/SwissProt
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PC cid
PC sid
UniChem

Similars

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