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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Matrix metalloproteinase-9' and Ligand = 'BDBM50128675'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Matrix metalloproteinase-9


(Homo sapiens (Human))
BDBM50128675
PNG
(1-Isopropyl-4-(4-methoxy-benzenesulfonyl)-piperidi...)
Show SMILES COc1ccc(cc1)S(=O)(=O)C1(CCN(CC1)C(C)C)C(=O)NO
Show InChI InChI=1S/C16H24N2O5S/c1-12(2)18-10-8-16(9-11-18,15(19)17-20)24(21,22)14-6-4-13(23-3)5-7-14/h4-7,12,20H,8-11H2,1-3H3,(H,17,19)
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MMDB

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Article
PubMed
n/an/a 374n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against matrix metalloprotease-9.


J Med Chem 46: 2376-96 (2003)


Article DOI: 10.1021/jm0205550
BindingDB Entry DOI: 10.7270/Q2N0178C
More data for this
Ligand-Target Pair