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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Matrix metalloproteinase-7 (MMP7)' and Ligand = 'BDBM50216004'   
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-7 (MMP7)


(Homo sapiens (Human))
BDBM50216004
PNG
(4-((2-methylquinolin-4-yl)methoxy)-N-(4-((5-thioxo...)
Show SMILES Cc1cc(COc2ccc(cc2)C(=O)NC2(Cc3n[nH]c(=S)[nH]3)CCOCC2)c2ccccc2n1
Show InChI InChI=1S/C26H27N5O3S/c1-17-14-19(21-4-2-3-5-22(21)27-17)16-34-20-8-6-18(7-9-20)24(32)29-26(10-12-33-13-11-26)15-23-28-25(35)31-30-23/h2-9,14H,10-13,15-16H2,1H3,(H,29,32)(H2,28,30,31,35)
PDB
MMDB

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Similars

Article
PubMed
635n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of MMP7


Bioorg Med Chem Lett 17: 4678-82 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.100
BindingDB Entry DOI: 10.7270/Q2H41R4X
More data for this
Ligand-Target Pair