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BDBM58066 4-[3-(2,4-Dihydroxy-phenyl)-1H-pyrazol-4-yloxy]-benzoic acid propyl ester::4-[[(3E)-3-(2-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)-3-pyrazolin-4-yl]oxy]benzoic acid propyl ester::4-[[(3E)-3-(2-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)-1,2-dihydropyrazol-4-yl]oxy]benzoic acid propyl ester::MLS000778941::SMR000415641::cid_16682263::propyl 4-[[(3E)-3-(2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)-1,2-dihydropyrazol-4-yl]oxy]benzoate::propyl 4-[[(3E)-3-(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-1,2-dihydropyrazol-4-yl]oxy]benzoate

SMILES: CCCOC(=O)c1ccc(Oc2c[nH]nc2-c2ccc(O)cc2O)cc1

InChI Key: InChIKey=CRPJJPYSSBAAHW-UHFFFAOYSA-N

Data: 2 EC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 58066   
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)
BDBM58066
PNG
(4-[3-(2,4-Dihydroxy-phenyl)-1H-pyrazol-4-yloxy]-be...)
Show SMILES CCCOC(=O)c1ccc(Oc2c[nH]nc2-c2ccc(O)cc2O)cc1
Show InChI InChI=1S/C19H18N2O5/c1-2-9-25-19(24)12-3-6-14(7-4-12)26-17-11-20-21-18(17)15-8-5-13(22)10-16(15)23/h3-8,10-11,22-23H,2,9H2,1H3,(H,20,21)
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
Purchase

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
streptokinase A precursor


(Streptococcus pyogenes M1 GAS)
BDBM58066
PNG
(4-[3-(2,4-Dihydroxy-phenyl)-1H-pyrazol-4-yloxy]-be...)
Show SMILES CCCOC(=O)c1ccc(Oc2c[nH]nc2-c2ccc(O)cc2O)cc1
Show InChI InChI=1S/C19H18N2O5/c1-2-9-25-19(24)12-3-6-14(7-4-12)26-17-11-20-21-18(17)15-8-5-13(22)10-16(15)23/h3-8,10-11,22-23H,2,9H2,1H3,(H,20,21)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 1.50E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Group A streptococcus, GAS, streptokinase, expression, virulence, inhibition, dose response, EC50 Assay Overview: The goal of this assa...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2736PBV
More data for this
Ligand-Target Pair