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Compile Data Set for Download or QSAR

Found 74 hits with Last Name = 'blagg' and Initial = 'ja'   
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
Collagenase 3


(Homo sapiens (Human))
BDBM50163809
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-[4-(4-oxazol-5-yl-phe...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)-c3cnco3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C24H23N3O7/c1-2-31-12-11-24(21(28)20(25)22(29)27-23(24)30)34-18-9-7-17(8-10-18)33-16-5-3-15(4-6-16)19-13-26-14-32-19/h3-10,13-14,20H,2,11-12,25H2,1H3,(H,27,29,30)
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n/an/a 0.540n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163808
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-{4-[4-(1H-pyrazol-4-y...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)-c3cn[nH]c3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C24H24N4O6/c1-2-32-12-11-24(21(29)20(25)22(30)28-23(24)31)34-19-9-7-18(8-10-19)33-17-5-3-15(4-6-17)16-13-26-27-14-16/h3-10,13-14,20H,2,11-12,25H2,1H3,(H,26,27)(H,28,30,31)
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n/an/a 0.610n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163812
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-[4-(4-fluoro-phenoxy)...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(F)cc3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C21H21FN2O6/c1-2-28-12-11-21(18(25)17(23)19(26)24-20(21)27)30-16-9-7-15(8-10-16)29-14-5-3-13(22)4-6-14/h3-10,17H,2,11-12,23H2,1H3,(H,24,26,27)
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n/an/a 0.870n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163807
PNG
(5-Amino-3-[4-(4-bromo-phenoxy)-phenoxy]-3-(2-ethox...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(Br)cc3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C21H21BrN2O6/c1-2-28-12-11-21(18(25)17(23)19(26)24-20(21)27)30-16-9-7-15(8-10-16)29-14-5-3-13(22)4-6-14/h3-10,17H,2,11-12,23H2,1H3,(H,24,26,27)
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n/an/a 0.870n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163824
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-[4-(4-imidazol-1-yl-p...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)-n3ccnc3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C24H24N4O6/c1-2-32-14-11-24(21(29)20(25)22(30)27-23(24)31)34-19-9-7-18(8-10-19)33-17-5-3-16(4-6-17)28-13-12-26-15-28/h3-10,12-13,15,20H,2,11,14,25H2,1H3,(H,27,30,31)
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n/an/a 0.950n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163799
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-[4-(4-[1,3,4]oxadiazo...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)-c3nnco3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C23H22N4O7/c1-2-31-12-11-23(19(28)18(24)20(29)26-22(23)30)34-17-9-7-16(8-10-17)33-15-5-3-14(4-6-15)21-27-25-13-32-21/h3-10,13,18H,2,11-12,24H2,1H3,(H,26,29,30)
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n/an/a 1n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163811
PNG
(5-Amino-3-[4-(4-chloro-phenoxy)-phenoxy]-3-(2-etho...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(Cl)cc3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C21H21ClN2O6/c1-2-28-12-11-21(18(25)17(23)19(26)24-20(21)27)30-16-9-7-15(8-10-16)29-14-5-3-13(22)4-6-14/h3-10,17H,2,11-12,23H2,1H3,(H,24,26,27)
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n/an/a 1.40n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163796
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-[4-(4-oxazol-2-yl-phe...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)-c3ncco3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C24H23N3O7/c1-2-31-13-11-24(20(28)19(25)21(29)27-23(24)30)34-18-9-7-17(8-10-18)33-16-5-3-15(4-6-16)22-26-12-14-32-22/h3-10,12,14,19H,2,11,13,25H2,1H3,(H,27,29,30)
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n/an/a 1.40n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163802
PNG
(5-Amino-3-[4-(biphenyl-4-yloxy)-phenoxy]-3-(2-etho...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)-c3ccccc3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C27H26N2O6/c1-2-33-17-16-27(24(30)23(28)25(31)29-26(27)32)35-22-14-12-21(13-15-22)34-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-15,23H,2,16-17,28H2,1H3,(H,29,31,32)
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n/an/a 1.70n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163828
PNG
(5-Butyl-5-[4-(4-fluoro-phenoxy)-phenoxy]-pyrimidin...)
Show SMILES CCCCC1(Oc2ccc(Oc3ccc(F)cc3)cc2)C(=O)NC(=O)NC1=O
Show InChI InChI=1S/C20H19FN2O5/c1-2-3-12-20(17(24)22-19(26)23-18(20)25)28-16-10-8-15(9-11-16)27-14-6-4-13(21)5-7-14/h4-11H,2-3,12H2,1H3,(H2,22,23,24,25,26)
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n/an/a 2n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163797
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-(4-p-tolyloxy-phenoxy...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(C)cc3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C22H24N2O6/c1-3-28-13-12-22(19(25)18(23)20(26)24-21(22)27)30-17-10-8-16(9-11-17)29-15-6-4-14(2)5-7-15/h4-11,18H,3,12-13,23H2,1-2H3,(H,24,26,27)
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n/an/a 2.10n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14


(Homo sapiens (Human))
BDBM50163809
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-[4-(4-oxazol-5-yl-phe...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)-c3cnco3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C24H23N3O7/c1-2-31-12-11-24(21(28)20(25)22(29)27-23(24)30)34-18-9-7-17(8-10-18)33-16-5-3-15(4-6-16)19-13-26-14-32-19/h3-10,13-14,20H,2,11-12,25H2,1H3,(H,27,29,30)
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n/an/a 3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 14


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163810
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-[4-(2-fluoro-phenoxy)...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccccc3F)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C21H21FN2O6/c1-2-28-12-11-21(18(25)17(23)19(26)24-20(21)27)30-14-9-7-13(8-10-14)29-16-6-4-3-5-15(16)22/h3-10,17H,2,11-12,23H2,1H3,(H,24,26,27)
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n/an/a 3.10n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163821
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-(4-o-tolyloxy-phenoxy...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccccc3C)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C22H24N2O6/c1-3-28-13-12-22(19(25)18(23)20(26)24-21(22)27)30-16-10-8-15(9-11-16)29-17-7-5-4-6-14(17)2/h4-11,18H,3,12-13,23H2,1-2H3,(H,24,26,27)
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n/an/a 3.10n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163819
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-[4-(4-thiazol-2-yl-ph...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)-c3nccs3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C24H23N3O6S/c1-2-31-13-11-24(20(28)19(25)21(29)27-23(24)30)33-18-9-7-17(8-10-18)32-16-5-3-15(4-6-16)22-26-12-14-34-22/h3-10,12,14,19H,2,11,13,25H2,1H3,(H,27,29,30)
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n/an/a 3.10n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163798
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-[4-(4-pyrrol-1-yl-phe...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)-n3cccc3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C25H25N3O6/c1-2-32-16-13-25(22(29)21(26)23(30)27-24(25)31)34-20-11-9-19(10-12-20)33-18-7-5-17(6-8-18)28-14-3-4-15-28/h3-12,14-15,21H,2,13,16,26H2,1H3,(H,27,30,31)
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n/an/a 3.10n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163814
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-[4-(4-thiazol-4-yl-ph...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)-c3cscn3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C24H23N3O6S/c1-2-31-12-11-24(21(28)20(25)22(29)27-23(24)30)33-18-9-7-17(8-10-18)32-16-5-3-15(4-6-16)19-13-34-14-26-19/h3-10,13-14,20H,2,11-12,25H2,1H3,(H,27,29,30)
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n/an/a 3.60n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163803
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-[4-(4-pyrazol-1-yl-ph...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)-n3cccn3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C24H24N4O6/c1-2-32-15-12-24(21(29)20(25)22(30)27-23(24)31)34-19-10-8-18(9-11-19)33-17-6-4-16(5-7-17)28-14-3-13-26-28/h3-11,13-14,20H,2,12,15,25H2,1H3,(H,27,30,31)
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n/an/a 3.80n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50410149
PNG
(CHEMBL2096775)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)-n3cncn3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C23H23N5O6/c1-2-32-12-11-23(20(29)19(24)21(30)27-22(23)31)34-18-9-7-17(8-10-18)33-16-5-3-15(4-6-16)28-14-25-13-26-28/h3-10,13-14,19H,2,11-12,24H2,1H3,(H,27,30,31)
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n/an/a 3.90n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163801
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-{4-[4-(2H-pyrazol-3-y...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)-c3cc[nH]n3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C24H24N4O6/c1-2-32-14-12-24(21(29)20(25)22(30)27-23(24)31)34-18-9-7-17(8-10-18)33-16-5-3-15(4-6-16)19-11-13-26-28-19/h3-11,13,20H,2,12,14,25H2,1H3,(H,26,28)(H,27,30,31)
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n/an/a 4.10n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163826
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-[4-(4-trifluoromethyl...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)C(F)(F)F)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C22H21F3N2O6/c1-2-31-12-11-21(18(28)17(26)19(29)27-20(21)30)33-16-9-7-15(8-10-16)32-14-5-3-13(4-6-14)22(23,24)25/h3-10,17H,2,11-12,26H2,1H3,(H,27,29,30)
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n/an/a 5n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163815
PNG
(4-{4-[5-Amino-3-(2-ethoxy-ethyl)-2,4,6-trioxo-pipe...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)C#N)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C22H21N3O6/c1-2-29-12-11-22(19(26)18(24)20(27)25-21(22)28)31-17-9-7-16(8-10-17)30-15-5-3-14(13-23)4-6-15/h3-10,18H,2,11-12,24H2,1H3,(H,25,27,28)
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n/an/a 5.90n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163817
PNG
(4-{4-[5-Amino-3-(2-ethoxy-ethyl)-2,4,6-trioxo-pipe...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)C(=O)NC)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C23H25N3O7/c1-3-31-13-12-23(19(27)18(24)21(29)26-22(23)30)33-17-10-8-16(9-11-17)32-15-6-4-14(5-7-15)20(28)25-2/h4-11,18H,3,12-13,24H2,1-2H3,(H,25,28)(H,26,29,30)
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n/an/a 6n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163813
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-[4-(4-[1,2,4]triazol-...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)-n3cnnc3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C23H23N5O6/c1-2-32-12-11-23(20(29)19(24)21(30)27-22(23)31)34-18-9-7-17(8-10-18)33-16-5-3-15(4-6-16)28-13-25-26-14-28/h3-10,13-14,19H,2,11-12,24H2,1H3,(H,27,30,31)
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n/an/a 8n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163827
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-[4-(3-fluoro-phenoxy)...)
Show SMILES CCOCCC1(Oc2ccc(Oc3cccc(F)c3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C21H21FN2O6/c1-2-28-11-10-21(18(25)17(23)19(26)24-20(21)27)30-15-8-6-14(7-9-15)29-16-5-3-4-13(22)12-16/h3-9,12,17H,2,10-11,23H2,1H3,(H,24,26,27)
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n/an/a 9.20n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14


(Homo sapiens (Human))
BDBM50163808
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-{4-[4-(1H-pyrazol-4-y...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)-c3cn[nH]c3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C24H24N4O6/c1-2-32-12-11-24(21(29)20(25)22(30)28-23(24)31)34-19-9-7-18(8-10-19)33-17-5-3-15(4-6-17)16-13-26-27-14-16/h3-10,13-14,20H,2,11-12,25H2,1H3,(H,26,27)(H,28,30,31)
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n/an/a 11n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 14


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163820
PNG
(5-Amino-3-{4-[4-(3,4-dihydro-2H-[1,2,4]triazol-3-y...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)C3=NCNN3)cc2)C(=O)NC(=O)C(N)C1=O |t:19|
Show InChI InChI=1S/C23H25N5O6/c1-2-32-12-11-23(19(29)18(24)21(30)27-22(23)31)34-17-9-7-16(8-10-17)33-15-5-3-14(4-6-15)20-25-13-26-28-20/h3-10,18,26H,2,11-13,24H2,1H3,(H,25,28)(H,27,30,31)
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n/an/a 15n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14


(Homo sapiens (Human))
BDBM50163810
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-[4-(2-fluoro-phenoxy)...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccccc3F)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C21H21FN2O6/c1-2-28-12-11-21(18(25)17(23)19(26)24-20(21)27)30-14-9-7-13(8-10-14)29-16-6-4-3-5-15(16)22/h3-10,17H,2,11-12,23H2,1H3,(H,24,26,27)
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n/an/a 16n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 14


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163822
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-[4-(4-oxazol-4-yl-phe...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)-c3cocn3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C24H23N3O7/c1-2-31-12-11-24(21(28)20(25)22(29)27-23(24)30)34-18-9-7-17(8-10-18)33-16-5-3-15(4-6-16)19-13-32-14-26-19/h3-10,13-14,20H,2,11-12,25H2,1H3,(H,27,29,30)
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n/an/a 18n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14


(Homo sapiens (Human))
BDBM50163811
PNG
(5-Amino-3-[4-(4-chloro-phenoxy)-phenoxy]-3-(2-etho...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(Cl)cc3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C21H21ClN2O6/c1-2-28-12-11-21(18(25)17(23)19(26)24-20(21)27)30-16-9-7-15(8-10-16)29-14-5-3-13(22)4-6-14/h3-10,17H,2,11-12,23H2,1H3,(H,24,26,27)
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n/an/a 18n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 14


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14


(Homo sapiens (Human))
BDBM50163824
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-[4-(4-imidazol-1-yl-p...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)-n3ccnc3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C24H24N4O6/c1-2-32-14-11-24(21(29)20(25)22(30)27-23(24)31)34-19-9-7-18(8-10-19)33-17-5-3-16(4-6-17)28-13-12-26-15-28/h3-10,12-13,15,20H,2,11,14,25H2,1H3,(H,27,30,31)
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n/an/a 18n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 14


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163816
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-(4-m-tolyloxy-phenoxy...)
Show SMILES CCOCCC1(Oc2ccc(Oc3cccc(C)c3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C22H24N2O6/c1-3-28-12-11-22(19(25)18(23)20(26)24-21(22)27)30-16-9-7-15(8-10-16)29-17-6-4-5-14(2)13-17/h4-10,13,18H,3,11-12,23H2,1-2H3,(H,24,26,27)
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n/an/a 19n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163804
PNG
(4-{4-[5-Amino-3-(2-ethoxy-ethyl)-2,4,6-trioxo-pipe...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)C(N)=O)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C22H23N3O7/c1-2-30-12-11-22(18(26)17(23)20(28)25-21(22)29)32-16-9-7-15(8-10-16)31-14-5-3-13(4-6-14)19(24)27/h3-10,17H,2,11-12,23H2,1H3,(H2,24,27)(H,25,28,29)
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n/an/a 19n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14


(Homo sapiens (Human))
BDBM50163807
PNG
(5-Amino-3-[4-(4-bromo-phenoxy)-phenoxy]-3-(2-ethox...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(Br)cc3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C21H21BrN2O6/c1-2-28-12-11-21(18(25)17(23)19(26)24-20(21)27)30-16-9-7-15(8-10-16)29-14-5-3-13(22)4-6-14/h3-10,17H,2,11-12,23H2,1H3,(H,24,26,27)
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n/an/a 19n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 14


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))
BDBM50163799
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-[4-(4-[1,3,4]oxadiazo...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)-c3nnco3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C23H22N4O7/c1-2-31-12-11-23(19(28)18(24)20(29)26-22(23)30)34-17-9-7-16(8-10-17)33-15-5-3-14(4-6-15)21-27-25-13-32-21/h3-10,13,18H,2,11-12,24H2,1H3,(H,26,29,30)
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n/an/a 21n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 2


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14


(Homo sapiens (Human))
BDBM50163798
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-[4-(4-pyrrol-1-yl-phe...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)-n3cccc3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C25H25N3O6/c1-2-32-16-13-25(22(29)21(26)23(30)27-24(25)31)34-20-11-9-19(10-12-20)33-18-7-5-17(6-8-18)28-14-3-4-15-28/h3-12,14-15,21H,2,13,16,26H2,1H3,(H,27,30,31)
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n/an/a 22n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 14


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14


(Homo sapiens (Human))
BDBM50163797
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-(4-p-tolyloxy-phenoxy...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(C)cc3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C22H24N2O6/c1-3-28-13-12-22(19(25)18(23)20(26)24-21(22)27)30-17-10-8-16(9-11-17)29-15-6-4-14(2)5-7-15/h4-11,18H,3,12-13,23H2,1-2H3,(H,24,26,27)
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n/an/a 23n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 14


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14


(Homo sapiens (Human))
BDBM50163812
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-[4-(4-fluoro-phenoxy)...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(F)cc3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C21H21FN2O6/c1-2-28-12-11-21(18(25)17(23)19(26)24-20(21)27)30-16-9-7-15(8-10-16)29-14-5-3-13(22)4-6-14/h3-10,17H,2,11-12,23H2,1H3,(H,24,26,27)
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n/an/a 23n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 14


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14


(Homo sapiens (Human))
BDBM50163801
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-{4-[4-(2H-pyrazol-3-y...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)-c3cc[nH]n3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C24H24N4O6/c1-2-32-14-12-24(21(29)20(25)22(30)27-23(24)31)34-18-9-7-17(8-10-18)33-16-5-3-15(4-6-16)19-11-13-26-28-19/h3-11,13,20H,2,12,14,25H2,1H3,(H,26,28)(H,27,30,31)
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n/an/a 27n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 14


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163805
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-[4-(4-methoxy-phenoxy...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(OC)cc3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C22H24N2O7/c1-3-29-13-12-22(19(25)18(23)20(26)24-21(22)27)31-17-10-8-16(9-11-17)30-15-6-4-14(28-2)5-7-15/h4-11,18H,3,12-13,23H2,1-2H3,(H,24,26,27)
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n/an/a 28n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Macrophage metalloelastase


(Homo sapiens (Human))
BDBM50163799
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-[4-(4-[1,3,4]oxadiazo...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)-c3nnco3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C23H22N4O7/c1-2-31-12-11-23(19(28)18(24)20(29)26-22(23)30)34-17-9-7-16(8-10-17)33-15-5-3-14(4-6-15)21-27-25-13-32-21/h3-10,13,18H,2,11-12,24H2,1H3,(H,26,29,30)
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n/an/a 29n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 12


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Neutrophil collagenase


(Homo sapiens (Human))
BDBM50163799
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-[4-(4-[1,3,4]oxadiazo...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)-c3nnco3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C23H22N4O7/c1-2-31-12-11-23(19(28)18(24)20(29)26-22(23)30)34-17-9-7-16(8-10-17)33-15-5-3-14(4-6-15)21-27-25-13-32-21/h3-10,13,18H,2,11-12,24H2,1H3,(H,26,29,30)
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n/an/a 31n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 8


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14


(Homo sapiens (Human))
BDBM50163802
PNG
(5-Amino-3-[4-(biphenyl-4-yloxy)-phenoxy]-3-(2-etho...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)-c3ccccc3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C27H26N2O6/c1-2-33-17-16-27(24(30)23(28)25(31)29-26(27)32)35-22-14-12-21(13-15-22)34-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-15,23H,2,16-17,28H2,1H3,(H,29,31,32)
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n/an/a 36n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 14


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14


(Homo sapiens (Human))
BDBM50163816
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-(4-m-tolyloxy-phenoxy...)
Show SMILES CCOCCC1(Oc2ccc(Oc3cccc(C)c3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C22H24N2O6/c1-3-28-12-11-22(19(25)18(23)20(26)24-21(22)27)30-16-9-7-15(8-10-16)29-17-6-4-5-14(2)13-17/h4-10,13,18H,3,11-12,23H2,1-2H3,(H,24,26,27)
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n/an/a 50n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 14


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163830
PNG
(5-Amino-3-[4-(3-chloro-phenoxy)-phenoxy]-3-(2-etho...)
Show SMILES CCOCCC1(Oc2ccc(Oc3cccc(Cl)c3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C21H21ClN2O6/c1-2-28-11-10-21(18(25)17(23)19(26)24-20(21)27)30-15-8-6-14(7-9-15)29-16-5-3-4-13(22)12-16/h3-9,12,17H,2,10-11,23H2,1H3,(H,24,26,27)
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n/an/a 53n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50163823
PNG
(4-{4-[5-Amino-3-(2-ethoxy-ethyl)-2,4,6-trioxo-pipe...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)C(=O)N(C)C)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C24H27N3O7/c1-4-32-14-13-24(20(28)19(25)21(29)26-23(24)31)34-18-11-9-17(10-12-18)33-16-7-5-15(6-8-16)22(30)27(2)3/h5-12,19H,4,13-14,25H2,1-3H3,(H,26,29,31)
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n/an/a 56n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 13


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14


(Homo sapiens (Human))
BDBM50163827
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-[4-(3-fluoro-phenoxy)...)
Show SMILES CCOCCC1(Oc2ccc(Oc3cccc(F)c3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C21H21FN2O6/c1-2-28-11-10-21(18(25)17(23)19(26)24-20(21)27)30-15-8-6-14(7-9-15)29-16-5-3-4-13(22)12-16/h3-9,12,17H,2,10-11,23H2,1H3,(H,24,26,27)
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n/an/a 60n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 14


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14


(Homo sapiens (Human))
BDBM50163821
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-(4-o-tolyloxy-phenoxy...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccccc3C)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C22H24N2O6/c1-3-28-13-12-22(19(25)18(23)20(26)24-21(22)27)30-16-10-8-15(9-11-16)29-17-7-5-4-6-14(17)2/h4-11,18H,3,12-13,23H2,1-2H3,(H,24,26,27)
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n/an/a 70n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 14


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14


(Homo sapiens (Human))
BDBM50163819
PNG
(5-Amino-3-(2-ethoxy-ethyl)-3-[4-(4-thiazol-2-yl-ph...)
Show SMILES CCOCCC1(Oc2ccc(Oc3ccc(cc3)-c3nccs3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C24H23N3O6S/c1-2-31-13-11-24(20(28)19(25)21(29)27-23(24)30)33-18-9-7-17(8-10-18)32-16-5-3-15(4-6-16)22-26-12-14-34-22/h3-10,12,14,19H,2,11,13,25H2,1H3,(H,27,29,30)
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n/an/a 75n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 14


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14


(Homo sapiens (Human))
BDBM50163830
PNG
(5-Amino-3-[4-(3-chloro-phenoxy)-phenoxy]-3-(2-etho...)
Show SMILES CCOCCC1(Oc2ccc(Oc3cccc(Cl)c3)cc2)C(=O)NC(=O)C(N)C1=O
Show InChI InChI=1S/C21H21ClN2O6/c1-2-28-11-10-21(18(25)17(23)19(26)24-20(21)27)30-15-8-6-14(7-9-15)29-16-5-3-4-13(22)12-16/h3-9,12,17H,2,10-11,23H2,1H3,(H,24,26,27)
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n/an/a 120n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration against matrix metalloprotease 14


Bioorg Med Chem Lett 15: 1807-10 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.038
BindingDB Entry DOI: 10.7270/Q2JH3KPW
More data for this
Ligand-Target Pair
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