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PubMed code 12798337

Compile data set for download or QSAR
Found 6 hits of Enzyme Inhibition Constant Data   
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
72 kDa type IV collagenase


(Homo sapiens (Human))
BDBM50084289
PNG
((S)-2-(4'-methoxy-biphenyl-4-sulfonylamino)-3-meth...)
Show SMILES COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)N[C@@H](C(C)C)C(O)=O
Show InChI InChI=1S/C18H21NO5S/c1-12(2)17(18(20)21)19-25(22,23)16-10-6-14(7-11-16)13-4-8-15(24-3)9-5-13/h4-12,17,19H,1-3H3,(H,20,21)/t17-/m0/s1
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PubMed
n/an/a 3n/an/an/an/an/an/a



Indiana University School of Medicine

Curated by ChEMBL


Assay Description
Inhibition of matrix metalloproteinase-2


Bioorg Med Chem Lett 13: 2217-22 (2003)


BindingDB Entry DOI: 10.7270/Q28G8K3B
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50084289
PNG
((S)-2-(4'-methoxy-biphenyl-4-sulfonylamino)-3-meth...)
Show SMILES COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)N[C@@H](C(C)C)C(O)=O
Show InChI InChI=1S/C18H21NO5S/c1-12(2)17(18(20)21)19-25(22,23)16-10-6-14(7-11-16)13-4-8-15(24-3)9-5-13/h4-12,17,19H,1-3H3,(H,20,21)/t17-/m0/s1
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n/an/a 6n/an/an/an/an/an/a



Indiana University School of Medicine

Curated by ChEMBL


Assay Description
Inhibition of human matrix metalloproteinase-13


Bioorg Med Chem Lett 13: 2217-22 (2003)


BindingDB Entry DOI: 10.7270/Q28G8K3B
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))
BDBM50084289
PNG
((S)-2-(4'-methoxy-biphenyl-4-sulfonylamino)-3-meth...)
Show SMILES COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)N[C@@H](C(C)C)C(O)=O
Show InChI InChI=1S/C18H21NO5S/c1-12(2)17(18(20)21)19-25(22,23)16-10-6-14(7-11-16)13-4-8-15(24-3)9-5-13/h4-12,17,19H,1-3H3,(H,20,21)/t17-/m0/s1
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n/an/a 8n/an/an/an/an/an/a



Indiana University School of Medicine

Curated by ChEMBL


Assay Description
Inhibition of matrix metalloproteinase-3


Bioorg Med Chem Lett 13: 2217-22 (2003)


BindingDB Entry DOI: 10.7270/Q28G8K3B
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))
BDBM50084289
PNG
((S)-2-(4'-methoxy-biphenyl-4-sulfonylamino)-3-meth...)
Show SMILES COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)N[C@@H](C(C)C)C(O)=O
Show InChI InChI=1S/C18H21NO5S/c1-12(2)17(18(20)21)19-25(22,23)16-10-6-14(7-11-16)13-4-8-15(24-3)9-5-13/h4-12,17,19H,1-3H3,(H,20,21)/t17-/m0/s1
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n/an/a 1.50E+3n/an/an/an/an/an/a



Indiana University School of Medicine

Curated by ChEMBL


Assay Description
Inhibition of matrix metalloproteinase-1


Bioorg Med Chem Lett 13: 2217-22 (2003)


BindingDB Entry DOI: 10.7270/Q28G8K3B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-9


(Homo sapiens (Human))
BDBM50084289
PNG
((S)-2-(4'-methoxy-biphenyl-4-sulfonylamino)-3-meth...)
Show SMILES COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)N[C@@H](C(C)C)C(O)=O
Show InChI InChI=1S/C18H21NO5S/c1-12(2)17(18(20)21)19-25(22,23)16-10-6-14(7-11-16)13-4-8-15(24-3)9-5-13/h4-12,17,19H,1-3H3,(H,20,21)/t17-/m0/s1
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n/an/a 2.20E+3n/an/an/an/an/an/a



Indiana University School of Medicine

Curated by ChEMBL


Assay Description
Inhibition of matrix metalloproteinase-9


Bioorg Med Chem Lett 13: 2217-22 (2003)


BindingDB Entry DOI: 10.7270/Q28G8K3B
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))
BDBM50084289
PNG
((S)-2-(4'-methoxy-biphenyl-4-sulfonylamino)-3-meth...)
Show SMILES COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)N[C@@H](C(C)C)C(O)=O
Show InChI InChI=1S/C18H21NO5S/c1-12(2)17(18(20)21)19-25(22,23)16-10-6-14(7-11-16)13-4-8-15(24-3)9-5-13/h4-12,17,19H,1-3H3,(H,20,21)/t17-/m0/s1
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n/an/a 7.20E+3n/an/an/an/an/an/a



Indiana University School of Medicine

Curated by ChEMBL


Assay Description
Inhibition of matrix metalloproteinase-7


Bioorg Med Chem Lett 13: 2217-22 (2003)


BindingDB Entry DOI: 10.7270/Q28G8K3B
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%