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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 = 'BDBM50227572'   
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))
BDBM50227572
PNG
(6-mercapto-pyridine-2-carboxylic acid 3-methyl-ben...)
Show SMILES Cc1cccc(COC(=O)c2cccc(=S)[nH]2)c1
Show InChI InChI=1S/C14H13NO2S/c1-10-4-2-5-11(8-10)9-17-14(16)12-6-3-7-13(18)15-12/h2-8H,9H2,1H3,(H,15,18)
PDB
MMDB

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Similars

Article
PubMed
n/an/a 7.00E+3n/an/an/an/an/an/a



North Dakota State University

Curated by ChEMBL


Assay Description
Inhibition of MMP9


Bioorg Med Chem Lett 17: 6864-70 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.020
BindingDB Entry DOI: 10.7270/Q2C24X80
More data for this
Ligand-Target Pair