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BDBM72270 (E)-2-butenedioic acid bis[2-(3-chloro-4-methoxyanilino)-2-oxoethyl] ester::(E)-but-2-enedioic acid bis[2-(3-chloro-4-methoxy-anilino)-2-keto-ethyl] ester::MLS000416385::SMR000264204::bis[2-(3-chloro-4-methoxyanilino)-2-oxoethyl] (E)-but-2-enedioate::bis[2-[(3-chloranyl-4-methoxy-phenyl)amino]-2-oxidanylidene-ethyl] (E)-but-2-enedioate::cid_5823841

SMILES: COc1ccc(NC(=O)COC(=O)\C=C\C(=O)OCC(=O)Nc2ccc(OC)c(Cl)c2)cc1Cl

InChI Key: InChIKey=QYIBZXMTOIPDDS-BQYQJAHWSA-N

Data: 1 EC50

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 72270   
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
Hsf1 protein


(Mus musculus)
BDBM72270
PNG
((E)-2-butenedioic acid bis[2-(3-chloro-4-methoxyan...)
Show SMILES COc1ccc(NC(=O)COC(=O)\C=C\C(=O)OCC(=O)Nc2ccc(OC)c(Cl)c2)cc1Cl
Show InChI InChI=1S/C22H20Cl2N2O8/c1-31-17-5-3-13(9-15(17)23)25-19(27)11-33-21(29)7-8-22(30)34-12-20(28)26-14-4-6-18(32-2)16(24)10-14/h3-10H,11-12H2,1-2H3,(H,25,27)(H,26,28)/b8-7+
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 6.53E+3n/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