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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 = 'BDBM50183736'   
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))
BDBM50183736
PNG
(CHEMBL207018 | N-(1-(2-fluoroethyl)-4-(2-(hydroxya...)
Show SMILES Cc1cc(COc2ccc(cc2)C(=O)NC2(CC(=O)NO)CCN(CCF)CC2)c2ccccc2n1
Show InChI InChI=1S/C27H31FN4O4/c1-19-16-21(23-4-2-3-5-24(23)29-19)18-36-22-8-6-20(7-9-22)26(34)30-27(17-25(33)31-35)10-13-32(14-11-27)15-12-28/h2-9,16,35H,10-15,17-18H2,1H3,(H,30,34)(H,31,33)
PDB
MMDB

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Similars

Article
PubMed
>2.13E+3n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Binding affinity to MMP9


Bioorg Med Chem Lett 16: 2699-704 (2006)


Article DOI: 10.1016/j.bmcl.2006.02.015
BindingDB Entry DOI: 10.7270/Q2TB16H3
More data for this
Ligand-Target Pair