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BDBM28315 (2R)-2-{[4-(4-chlorophenyl)benzene][2-(2-oxopyrrolidin-1-yl)ethyl]sulfonamido}-2-methyl-3-phenylpropanoic acid::sulfonylamino-alkanecarboxylate, 14

SMILES: C[C@](Cc1ccccc1)(N(CCN1CCCC1=O)S(=O)(=O)c1ccc(cc1)-c1ccc(Cl)cc1)C(O)=O

InChI Key: InChIKey=LKBXWWXGNYTFLM-MUUNZHRXSA-N

Data: 1 Other

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 28315   
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
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM28315
PNG
((2R)-2-{[4-(4-chlorophenyl)benzene][2-(2-oxopyrrol...)
Show SMILES C[C@](Cc1ccccc1)(N(CCN1CCCC1=O)S(=O)(=O)c1ccc(cc1)-c1ccc(Cl)cc1)C(O)=O
Show InChI InChI=1S/C28H29ClN2O5S/c1-28(27(33)34,20-21-6-3-2-4-7-21)31(19-18-30-17-5-8-26(30)32)37(35,36)25-15-11-23(12-16-25)22-9-13-24(29)14-10-22/h2-4,6-7,9-16H,5,8,17-20H2,1H3,(H,33,34)/t28-/m1/s1
PDB
MMDB

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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/an/an/an/a7.537



Japan Tobacco Inc.



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)

More data for this
Ligand-Target Pair