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BDBM24046 (2R)-2-[(4-{4-[(E)-2-(1-benzofuran-2-yl)ethenyl]phenyl}benzene)sulfonamido]-3-methylbutanoic acid::biphenylsulfonamide carboxylate, 23

SMILES: CC(C)[C@@H](NS(=O)(=O)c1ccc(cc1)-c1ccc(\C=C\c2cc3ccccc3o2)cc1)C(O)=O

InChI Key: InChIKey=NNCMZAJUJIFSSX-JMTVYCCQNA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 24046   
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))
BDBM24046
PNG
((2R)-2-[(4-{4-[(E)-2-(1-benzofuran-2-yl)ethenyl]ph...)
Show SMILES CC(C)[C@@H](NS(=O)(=O)c1ccc(cc1)-c1ccc(\C=C\c2cc3ccccc3o2)cc1)C(O)=O
Show InChI InChI=1/C27H25NO5S/c1-18(2)26(27(29)30)28-34(31,32)24-15-12-21(13-16-24)20-10-7-19(8-11-20)9-14-23-17-22-5-3-4-6-25(22)33-23/h3-18,26,28H,1-2H3,(H,29,30)/b14-9+/t26-/s2
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MMDB

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Article
PubMed
n/an/a 400n/an/an/an/a7.530



Wyeth Research



Assay Description
The recombinant Agg-1 proteins pretreated with the various concentrations of the compound for 10 to 15 min. The reaction was initiated by addition of...


Bioorg Med Chem Lett 16: 311-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.001
BindingDB Entry DOI: 10.7270/Q2CJ8BS1
More data for this
Ligand-Target Pair