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SMILES: ONC(=O)C(CCCN1C(=O)c2ccccc2C1=O)COc1ccc(cc1)-c1ccccc1

InChI Key: InChIKey=QYMKPTMAFMKKTC-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50096653   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Matrix metalloproteinase-9


(Homo sapiens (Human))
BDBM50096653
PNG
(2-(Biphenyl-4-yloxymethyl)-5-(1,3-dioxo-1,3-dihydr...)
Show SMILES ONC(=O)C(CCCN1C(=O)c2ccccc2C1=O)COc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C26H24N2O5/c29-24(27-32)20(9-6-16-28-25(30)22-10-4-5-11-23(22)26(28)31)17-33-21-14-12-19(13-15-21)18-7-2-1-3-8-18/h1-5,7-8,10-15,20,32H,6,9,16-17H2,(H,27,29)
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n/an/a 221n/an/an/an/an/an/a



Institut de Recherches Servier

Curated by ChEMBL


Assay Description
Inhibition of Matrix metalloproteinase-9


Bioorg Med Chem Lett 11: 295-9 (2001)


BindingDB Entry DOI: 10.7270/Q2JH3KD9
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50096653
PNG
(2-(Biphenyl-4-yloxymethyl)-5-(1,3-dioxo-1,3-dihydr...)
Show SMILES ONC(=O)C(CCCN1C(=O)c2ccccc2C1=O)COc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C26H24N2O5/c29-24(27-32)20(9-6-16-28-25(30)22-10-4-5-11-23(22)26(28)31)17-33-21-14-12-19(13-15-21)18-7-2-1-3-8-18/h1-5,7-8,10-15,20,32H,6,9,16-17H2,(H,27,29)
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n/an/a 485n/an/an/an/an/an/a



Institut de Recherches Servier

Curated by ChEMBL


Assay Description
Inhibition of Matrix metalloproteinase-13


Bioorg Med Chem Lett 11: 295-9 (2001)


BindingDB Entry DOI: 10.7270/Q2JH3KD9
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))
BDBM50096653
PNG
(2-(Biphenyl-4-yloxymethyl)-5-(1,3-dioxo-1,3-dihydr...)
Show SMILES ONC(=O)C(CCCN1C(=O)c2ccccc2C1=O)COc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C26H24N2O5/c29-24(27-32)20(9-6-16-28-25(30)22-10-4-5-11-23(22)26(28)31)17-33-21-14-12-19(13-15-21)18-7-2-1-3-8-18/h1-5,7-8,10-15,20,32H,6,9,16-17H2,(H,27,29)
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n/an/a 313n/an/an/an/an/an/a



Institut de Recherches Servier

Curated by ChEMBL


Assay Description
Inhibition of Matrix metalloproteinase-3


Bioorg Med Chem Lett 11: 295-9 (2001)


BindingDB Entry DOI: 10.7270/Q2JH3KD9
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))
BDBM50096653
PNG
(2-(Biphenyl-4-yloxymethyl)-5-(1,3-dioxo-1,3-dihydr...)
Show SMILES ONC(=O)C(CCCN1C(=O)c2ccccc2C1=O)COc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C26H24N2O5/c29-24(27-32)20(9-6-16-28-25(30)22-10-4-5-11-23(22)26(28)31)17-33-21-14-12-19(13-15-21)18-7-2-1-3-8-18/h1-5,7-8,10-15,20,32H,6,9,16-17H2,(H,27,29)
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n/an/a>1.00E+3n/an/an/an/an/an/a



Institut de Recherches Servier

Curated by ChEMBL


Assay Description
Inhibition of Matrix metalloproteinase-1


Bioorg Med Chem Lett 11: 295-9 (2001)


BindingDB Entry DOI: 10.7270/Q2JH3KD9
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))
BDBM50096653
PNG
(2-(Biphenyl-4-yloxymethyl)-5-(1,3-dioxo-1,3-dihydr...)
Show SMILES ONC(=O)C(CCCN1C(=O)c2ccccc2C1=O)COc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C26H24N2O5/c29-24(27-32)20(9-6-16-28-25(30)22-10-4-5-11-23(22)26(28)31)17-33-21-14-12-19(13-15-21)18-7-2-1-3-8-18/h1-5,7-8,10-15,20,32H,6,9,16-17H2,(H,27,29)
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PubMed
n/an/a 82n/an/an/an/an/an/a



Institut de Recherches Servier

Curated by ChEMBL


Assay Description
Inhibition of Matrix metalloproteinase-2


Bioorg Med Chem Lett 11: 295-9 (2001)


BindingDB Entry DOI: 10.7270/Q2JH3KD9
More data for this
Ligand-Target Pair