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BDBM50259577 (R)-2-(4'-((3-fluorophenoxy)methyl)biphenyl-4-ylsulfonamido)-3-methylbutanoic acid::CHEMBL466488

SMILES: CC(C)[C@@H](NS(=O)(=O)c1ccc(cc1)-c1ccc(COc2cccc(F)c2)cc1)C(O)=O

InChI Key: InChIKey=BGYMSYXWFYDPQT-HSZRJFAPSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50259577   
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 4 (ADAMTS-4)


(Homo sapiens (Human))
BDBM50259577
PNG
((R)-2-(4'-((3-fluorophenoxy)methyl)biphenyl-4-ylsu...)
Show SMILES CC(C)[C@@H](NS(=O)(=O)c1ccc(cc1)-c1ccc(COc2cccc(F)c2)cc1)C(O)=O |r|
Show InChI InChI=1S/C24H24FNO5S/c1-16(2)23(24(27)28)26-32(29,30)22-12-10-19(11-13-22)18-8-6-17(7-9-18)15-31-21-5-3-4-20(25)14-21/h3-14,16,23,26H,15H2,1-2H3,(H,27,28)/t23-/m1/s1
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Article
PubMed
n/an/a 1.20E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of aggrecanase1


Bioorg Med Chem Lett 19: 2487-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.056
BindingDB Entry DOI: 10.7270/Q29886WB
More data for this
Ligand-Target Pair