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BDBM28310 (2R)-2-{[4-(4-chlorophenyl)benzene](cyclohexylmethyl)sulfonamido}-3-phenylpropanoic acid::sulfonylamino-alkanecarboxylate, 5

SMILES: OC(=O)[C@@H](Cc1ccccc1)N(CC1CCCCC1)S(=O)(=O)c1ccc(cc1)-c1ccc(Cl)cc1

InChI Key: InChIKey=YZPAZTZITSDVIU-HHHXNRCGSA-N

Data: 1 Other

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 28310   
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))
BDBM28310
PNG
((2R)-2-{[4-(4-chlorophenyl)benzene](cyclohexylmeth...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)N(CC1CCCCC1)S(=O)(=O)c1ccc(cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C28H30ClNO4S/c29-25-15-11-23(12-16-25)24-13-17-26(18-14-24)35(33,34)30(20-22-9-5-2-6-10-22)27(28(31)32)19-21-7-3-1-4-8-21/h1,3-4,7-8,11-18,22,27H,2,5-6,9-10,19-20H2,(H,31,32)/t27-/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