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BDBM50396174 CHEMBL2171899

SMILES: [#6]-[#6]-[#8]-c1cc(\[#6]=[#6]-2/[#6](=O)-c3ccccc3-[#6]-2=O)cc(Cl)c1-[#8]-[#6]-c1cccc(c1)-[#6](-[#8])=O

InChI Key: InChIKey=ZDUULZLOFHAOSM-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50396174   
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
Signal transducer and activator of transcription 3


(Homo sapiens (Human))
BDBM50396174
PNG
(CHEMBL2171899)
Show SMILES [#6]-[#6]-[#8]-c1cc(\[#6]=[#6]-2/[#6](=O)-c3ccccc3-[#6]-2=O)cc(Cl)c1-[#8]-[#6]-c1cccc(c1)-[#6](-[#8])=O
Show InChI InChI=1S/C26H19ClO6/c1-2-32-22-13-16(11-20-23(28)18-8-3-4-9-19(18)24(20)29)12-21(27)25(22)33-14-15-6-5-7-17(10-15)26(30)31/h3-13H,2,14H2,1H3,(H,30,31)
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UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.56E+5n/an/an/an/an/an/a



University of Southern California

Curated by ChEMBL


Assay Description
Inhibition of recombinant STAT3 assessed as inhibition of STAT3-phosphododecapeptide interaction by SPR analysis


J Med Chem 55: 6645-68 (2012)


Article DOI: 10.1021/jm300207s
BindingDB Entry DOI: 10.7270/Q2CJ8FKK
More data for this
Ligand-Target Pair
Signal transducer and activator of transcription 3


(Homo sapiens (Human))
BDBM50396174
PNG
(CHEMBL2171899)
Show SMILES [#6]-[#6]-[#8]-c1cc(\[#6]=[#6]-2/[#6](=O)-c3ccccc3-[#6]-2=O)cc(Cl)c1-[#8]-[#6]-c1cccc(c1)-[#6](-[#8])=O
Show InChI InChI=1S/C26H19ClO6/c1-2-32-22-13-16(11-20-23(28)18-8-3-4-9-19(18)24(20)29)12-21(27)25(22)33-14-15-6-5-7-17(10-15)26(30)31/h3-13H,2,14H2,1H3,(H,30,31)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.44E+5n/an/an/an/an/an/a



University of Southern California

Curated by ChEMBL


Assay Description
Inhibition of IL6-mediated STAT3 phosphorylation in human HepG2 cells preincubated for 1 hr prior to IL6 challenge measured after 30 mins by immunobl...


J Med Chem 55: 6645-68 (2012)


Article DOI: 10.1021/jm300207s
BindingDB Entry DOI: 10.7270/Q2CJ8FKK
More data for this
Ligand-Target Pair