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BDBM50202185 5-((5-(4-fluorophenethoxy)-1-phenyl-3-(trifluoromethyl)-1H-pyrazol-4-yl)methylene)-2-thioxothiazolidin-4-one::CHEMBL391928

SMILES: Fc1ccc(CCOc2c(C=C3SC(S)=NC3=O)c(nn2-c2ccccc2)C(F)(F)F)cc1

InChI Key: InChIKey=GJAAXQZMSBKVKM-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50202185   
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
A disintegrin and metalloproteinase with thrombospondin motifs 5 (ADAMTS-5)


(Homo sapiens (Human))
BDBM50202185
PNG
(5-((5-(4-fluorophenethoxy)-1-phenyl-3-(trifluorome...)
Show SMILES Fc1ccc(CCOc2c(C=C3SC(S)=NC3=O)c(nn2-c2ccccc2)C(F)(F)F)cc1 |w:10.9,c:14|
Show InChI InChI=1S/C22H15F4N3O2S2/c23-14-8-6-13(7-9-14)10-11-31-20-16(12-17-19(30)27-21(32)33-17)18(22(24,25)26)28-29(20)15-4-2-1-3-5-15/h1-9,12H,10-11H2,(H,27,30,32)
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MMDB

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Article
PubMed
n/an/a 7.10E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of ADAMTS5 by FRET assay


Bioorg Med Chem Lett 17: 1189-92 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.020
BindingDB Entry DOI: 10.7270/Q2JW8DK5
More data for this
Ligand-Target Pair