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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 = 'BDBM50213419'   
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))
BDBM50213419
PNG
((2E)-3-(N-hydroxycarbamoyl)-2-(3-phenylpropylidene...)
Show SMILES CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C(CC(=O)NO)=CCCc1ccccc1 |w:24.26|
Show InChI InChI=1S/C25H28N4O4/c1-26-25(32)22(14-19-16-27-21-13-6-5-12-20(19)21)28-24(31)18(15-23(30)29-33)11-7-10-17-8-3-2-4-9-17/h2-6,8-9,11-13,16,22,27,33H,7,10,14-15H2,1H3,(H,26,32)(H,28,31)(H,29,30)/t22-/m0/s1
PDB
MMDB

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Similars

Article
PubMed
n/an/a 45n/an/an/an/an/an/a



Université de Reims-Champagne-Ardenne

Curated by ChEMBL


Assay Description
Inhibition of MMP9


Bioorg Med Chem 15: 4753-66 (2007)


Article DOI: 10.1016/j.bmc.2007.05.001
BindingDB Entry DOI: 10.7270/Q2Q23ZXN
More data for this
Ligand-Target Pair