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PubMed code 10639284

Compile data set for download or QSAR
Found 119 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
Collagenase 3


(Homo sapiens (Human))		BDBM50084219
PNG
((R)-4-[(Z)-Benzyloxyimino]-1-(4-butoxy-benzenesulf...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OCc1ccccc1
Show InChI InChI=1S/C22H27N3O6S/c1-2-3-13-30-19-9-11-20(12-10-19)32(28,29)25-15-18(14-21(25)22(26)23-27)24-31-16-17-7-5-4-6-8-17/h4-12,21,27H,2-3,13-16H2,1H3,(H,23,26)/b24-18-/t21-/m1/s1
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n/an/a 0.100n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-3 (Matrix metalloproteinase-13)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))		BDBM50084222
PNG
((R)-4-[(Z)-Hydroxyimino]-1-(4-methoxy-benzenesulfo...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N1C=C(C[C@@H]1C(=O)NO)NO |c:13|
Show InChI InChI=1S/C12H15N3O6S/c1-21-9-2-4-10(5-3-9)22(19,20)15-7-8(13-17)6-11(15)12(16)14-18/h2-5,7,11,13,17-18H,6H2,1H3,(H,14,16)/t11-/m1/s1
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n/an/a 0.200n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against gelatinase-A (matrix metalloproteinase-2).

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))		BDBM50084202
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-[(Z)-hydroxyimi...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C=C(C[C@@H]1C(=O)NO)NO |c:16|
Show InChI InChI=1S/C15H21N3O6S/c1-2-3-8-24-12-4-6-13(7-5-12)25(22,23)18-10-11(16-20)9-14(18)15(19)17-21/h4-7,10,14,16,20-21H,2-3,8-9H2,1H3,(H,17,19)/t14-/m1/s1
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n/an/a 0.200n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against gelatinase-A (matrix metalloproteinase-2).

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))		BDBM50084222
PNG
((R)-4-[(Z)-Hydroxyimino]-1-(4-methoxy-benzenesulfo...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N1C=C(C[C@@H]1C(=O)NO)NO |c:13|
Show InChI InChI=1S/C12H15N3O6S/c1-21-9-2-4-10(5-3-9)22(19,20)15-7-8(13-17)6-11(15)12(16)14-18/h2-5,7,11,13,17-18H,6H2,1H3,(H,14,16)/t11-/m1/s1
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n/an/a 0.200n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-3 (Matrix metalloproteinase-13)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))		BDBM50084207
PNG
((R)-4-[(Z)-tert-Butoxyimino]-1-[4-(4-fluoro-phenox...)
Show SMILES CC(C)(C)O\N=C1\C[C@@H](N(C1)S(=O)(=O)c1ccc(Oc2ccc(F)cc2)cc1)C(=O)NO
Show InChI InChI=1S/C21H24FN3O6S/c1-21(2,3)31-24-15-12-19(20(26)23-27)25(13-15)32(28,29)18-10-8-17(9-11-18)30-16-6-4-14(22)5-7-16/h4-11,19,27H,12-13H2,1-3H3,(H,23,26)/b24-15-/t19-/m1/s1
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n/an/a 0.200n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-3 (Matrix metalloproteinase-13)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))		BDBM50084202
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-[(Z)-hydroxyimi...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C=C(C[C@@H]1C(=O)NO)NO |c:16|
Show InChI InChI=1S/C15H21N3O6S/c1-2-3-8-24-12-4-6-13(7-5-12)25(22,23)18-10-11(16-20)9-14(18)15(19)17-21/h4-7,10,14,16,20-21H,2-3,8-9H2,1H3,(H,17,19)/t14-/m1/s1
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n/an/a 0.300n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-3 (Matrix metalloproteinase-13)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))		BDBM50084226
PNG
((R)-1-(4-Ethoxy-benzenesulfonyl)-4-[(Z)-methoxyimi...)
Show SMILES CCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OC
Show InChI InChI=1S/C14H19N3O6S/c1-3-23-11-4-6-12(7-5-11)24(20,21)17-9-10(16-22-2)8-13(17)14(18)15-19/h4-7,13,19H,3,8-9H2,1-2H3,(H,15,18)/b16-10-/t13-/m1/s1
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n/an/a 0.300n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against gelatinase-A (matrix metalloproteinase-2).

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))		BDBM50084198
PNG
((R)-4-[(Z)-Methoxyimino]-1-[4-(pyridin-4-yloxy)-be...)
Show SMILES CO\N=C1\C[C@@H](N(C1)S(=O)(=O)c1ccc(Oc2ccncc2)cc1)C(=O)NO
Show InChI InChI=1S/C17H18N4O6S/c1-26-20-12-10-16(17(22)19-23)21(11-12)28(24,25)15-4-2-13(3-5-15)27-14-6-8-18-9-7-14/h2-9,16,23H,10-11H2,1H3,(H,19,22)/b20-12-/t16-/m1/s1
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n/an/a 0.300n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against gelatinase-A (matrix metalloproteinase-2).

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))		BDBM50084206
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-[(Z)-methoxyimi...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OC
Show InChI InChI=1S/C16H23N3O6S/c1-3-4-9-25-13-5-7-14(8-6-13)26(22,23)19-11-12(18-24-2)10-15(19)16(20)17-21/h5-8,15,21H,3-4,9-11H2,1-2H3,(H,17,20)/b18-12-/t15-/m1/s1
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n/an/a 0.300n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-3 (Matrix metalloproteinase-13)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))		BDBM50084199
PNG
((R)-4-[(Z)-Phenoxyimino]-1-[4-(pyridin-4-yloxy)-be...)
Show SMILES ONC(=O)[C@H]1C\C(CN1S(=O)(=O)c1ccc(Oc2ccncc2)cc1)=N\Oc1ccccc1
Show InChI InChI=1S/C22H20N4O6S/c27-22(24-28)21-14-16(25-32-19-4-2-1-3-5-19)15-26(21)33(29,30)20-8-6-17(7-9-20)31-18-10-12-23-13-11-18/h1-13,21,28H,14-15H2,(H,24,27)/b25-16-/t21-/m1/s1
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n/an/a 0.400n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-3 (Matrix metalloproteinase-13)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))		BDBM50084217
PNG
((R)-4-Methylene-1-(4-phenoxy-benzenesulfonyl)-pyrr...)
Show SMILES ONC(=O)[C@H]1CC(=C)CN1S(=O)(=O)c1ccc(Oc2ccccc2)cc1
Show InChI InChI=1S/C18H18N2O5S/c1-13-11-17(18(21)19-22)20(12-13)26(23,24)16-9-7-15(8-10-16)25-14-5-3-2-4-6-14/h2-10,17,22H,1,11-12H2,(H,19,21)/t17-/m1/s1
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n/an/a 0.400n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against gelatinase-A (matrix metalloproteinase-2).

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))		BDBM50084208
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-[(Z)-tert-butox...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OC(C)(C)C
Show InChI InChI=1S/C19H29N3O6S/c1-5-6-11-27-15-7-9-16(10-8-15)29(25,26)22-13-14(21-28-19(2,3)4)12-17(22)18(23)20-24/h7-10,17,24H,5-6,11-13H2,1-4H3,(H,20,23)/b21-14-/t17-/m1/s1
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n/an/a 0.400n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-3 (Matrix metalloproteinase-13)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))		BDBM50084203
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-[(Z)-ethoxyimin...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OCC
Show InChI InChI=1S/C17H25N3O6S/c1-3-5-10-25-14-6-8-15(9-7-14)27(23,24)20-12-13(19-26-4-2)11-16(20)17(21)18-22/h6-9,16,22H,3-5,10-12H2,1-2H3,(H,18,21)/b19-13-/t16-/m1/s1
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n/an/a 0.5n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-3 (Matrix metalloproteinase-13)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))		BDBM50084209
PNG
((R)-1-[4-(2-Methoxy-ethoxy)-benzenesulfonyl]-4-[(Z...)
Show SMILES COCCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OC
Show InChI InChI=1S/C15H21N3O7S/c1-23-7-8-25-12-3-5-13(6-4-12)26(21,22)18-10-11(17-24-2)9-14(18)15(19)16-20/h3-6,14,20H,7-10H2,1-2H3,(H,16,19)/b17-11-/t14-/m1/s1
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n/an/a 0.5n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against gelatinase-A (matrix metalloproteinase-2).

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))		BDBM50084208
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-[(Z)-tert-butox...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OC(C)(C)C
Show InChI InChI=1S/C19H29N3O6S/c1-5-6-11-27-15-7-9-16(10-8-15)29(25,26)22-13-14(21-28-19(2,3)4)12-17(22)18(23)20-24/h7-10,17,24H,5-6,11-13H2,1-4H3,(H,20,23)/b21-14-/t17-/m1/s1
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n/an/a 0.5n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against gelatinase-A (matrix metalloproteinase-2).

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))		BDBM50084226
PNG
((R)-1-(4-Ethoxy-benzenesulfonyl)-4-[(Z)-methoxyimi...)
Show SMILES CCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OC
Show InChI InChI=1S/C14H19N3O6S/c1-3-23-11-4-6-12(7-5-11)24(20,21)17-9-10(16-22-2)8-13(17)14(18)15-19/h4-7,13,19H,3,8-9H2,1-2H3,(H,15,18)/b16-10-/t13-/m1/s1
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n/an/a 0.700n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-3 (Matrix metalloproteinase-13)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))		BDBM50084197
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-methylene-pyrro...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1CC(=C)C[C@@H]1C(=O)NO
Show InChI InChI=1S/C16H22N2O5S/c1-3-4-9-23-13-5-7-14(8-6-13)24(21,22)18-11-12(2)10-15(18)16(19)17-20/h5-8,15,20H,2-4,9-11H2,1H3,(H,17,19)/t15-/m1/s1
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n/an/a 0.700n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-3 (Matrix metalloproteinase-13)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))		BDBM50084201
PNG
((R)-4-[(Z)-tert-Butoxyimino]-1-(4-methoxy-benzenes...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OC(C)(C)C
Show InChI InChI=1S/C16H23N3O6S/c1-16(2,3)25-18-11-9-14(15(20)17-21)19(10-11)26(22,23)13-7-5-12(24-4)6-8-13/h5-8,14,21H,9-10H2,1-4H3,(H,17,20)/b18-11-/t14-/m1/s1
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n/an/a 0.700n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against gelatinase-A (matrix metalloproteinase-2).

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))		BDBM50084197
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-methylene-pyrro...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1CC(=C)C[C@@H]1C(=O)NO
Show InChI InChI=1S/C16H22N2O5S/c1-3-4-9-23-13-5-7-14(8-6-13)24(21,22)18-11-12(2)10-15(18)16(19)17-20/h5-8,15,20H,2-4,9-11H2,1H3,(H,17,19)/t15-/m1/s1
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n/an/a 0.800n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against gelatinase-A (matrix metalloproteinase-2).

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))		BDBM50084205
PNG
((R)-1-[4-(4-Fluoro-phenoxy)-benzenesulfonyl]-4-[(Z...)
Show SMILES CO\N=C1\C[C@@H](N(C1)S(=O)(=O)c1ccc(Oc2ccc(F)cc2)cc1)C(=O)NO
Show InChI InChI=1S/C18H18FN3O6S/c1-27-21-13-10-17(18(23)20-24)22(11-13)29(25,26)16-8-6-15(7-9-16)28-14-4-2-12(19)3-5-14/h2-9,17,24H,10-11H2,1H3,(H,20,23)/b21-13-/t17-/m1/s1
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n/an/a 0.800n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-3 (Matrix metalloproteinase-13)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))		BDBM50084206
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-[(Z)-methoxyimi...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OC
Show InChI InChI=1S/C16H23N3O6S/c1-3-4-9-25-13-5-7-14(8-6-13)26(22,23)19-11-12(18-24-2)10-15(19)16(20)17-21/h5-8,15,21H,3-4,9-11H2,1-2H3,(H,17,20)/b18-12-/t15-/m1/s1
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n/an/a 1n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))		BDBM50084213
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-methoxyamino-py...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1CC(C[C@@H]1C(=O)NO)NOC
Show InChI InChI=1S/C16H25N3O6S/c1-3-4-9-25-13-5-7-14(8-6-13)26(22,23)19-11-12(18-24-2)10-15(19)16(20)17-21/h5-8,12,15,18,21H,3-4,9-11H2,1-2H3,(H,17,20)/t12?,15-/m1/s1
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n/an/a 1n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against gelatinase-A (matrix metalloproteinase-2).

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))		BDBM50084211
PNG
((R)-4-Methylene-1-(4-propoxy-benzenesulfonyl)-pyrr...)
Show SMILES CCCOc1ccc(cc1)S(=O)(=O)N1CC(=C)C[C@@H]1C(=O)NO
Show InChI InChI=1S/C15H20N2O5S/c1-3-8-22-12-4-6-13(7-5-12)23(20,21)17-10-11(2)9-14(17)15(18)16-19/h4-7,14,19H,2-3,8-10H2,1H3,(H,16,18)/t14-/m1/s1
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n/an/a 1n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-3 (Matrix metalloproteinase-13)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))		BDBM50084203
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-[(Z)-ethoxyimin...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OCC
Show InChI InChI=1S/C17H25N3O6S/c1-3-5-10-25-14-6-8-15(9-7-14)27(23,24)20-12-13(19-26-4-2)11-16(20)17(21)18-22/h6-9,16,22H,3-5,10-12H2,1-2H3,(H,18,21)/b19-13-/t16-/m1/s1
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n/an/a 2n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))		BDBM50084221
PNG
((R)-4-[(Z)-Methoxyimino]-1-(4-propoxy-benzenesulfo...)
Show SMILES CCCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OC
Show InChI InChI=1S/C15H21N3O6S/c1-3-8-24-12-4-6-13(7-5-12)25(21,22)18-10-11(17-23-2)9-14(18)15(19)16-20/h4-7,14,20H,3,8-10H2,1-2H3,(H,16,19)/b17-11-/t14-/m1/s1
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n/an/a 2n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))		BDBM50084211
PNG
((R)-4-Methylene-1-(4-propoxy-benzenesulfonyl)-pyrr...)
Show SMILES CCCOc1ccc(cc1)S(=O)(=O)N1CC(=C)C[C@@H]1C(=O)NO
Show InChI InChI=1S/C15H20N2O5S/c1-3-8-22-12-4-6-13(7-5-12)23(20,21)17-10-11(2)9-14(17)15(18)16-19/h4-7,14,19H,2-3,8-10H2,1H3,(H,16,18)/t14-/m1/s1
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n/an/a 2n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against gelatinase-A (matrix metalloproteinase-2).

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))		BDBM50084213
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-methoxyamino-py...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1CC(C[C@@H]1C(=O)NO)NOC
Show InChI InChI=1S/C16H25N3O6S/c1-3-4-9-25-13-5-7-14(8-6-13)26(22,23)19-11-12(18-24-2)10-15(19)16(20)17-21/h5-8,12,15,18,21H,3-4,9-11H2,1-2H3,(H,17,20)/t12?,15-/m1/s1
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n/an/a 2n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-3 (Matrix metalloproteinase-13)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))		BDBM50084212
PNG
((R)-4-[(Z)-Methoxyimino]-1-(4-phenoxy-benzenesulfo...)
Show SMILES CO\N=C1\C[C@@H](N(C1)S(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)NO
Show InChI InChI=1S/C18H19N3O6S/c1-26-20-13-11-17(18(22)19-23)21(12-13)28(24,25)16-9-7-15(8-10-16)27-14-5-3-2-4-6-14/h2-10,17,23H,11-12H2,1H3,(H,19,22)/b20-13-/t17-/m1/s1
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n/an/a 2n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))		BDBM50084224
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-[(Z)-morpholin-...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C=C(C[C@@H]1C(=O)NO)NN1CCOCC1 |c:16|
Show InChI InChI=1S/C19H28N4O6S/c1-2-3-10-29-16-4-6-17(7-5-16)30(26,27)23-14-15(13-18(23)19(24)21-25)20-22-8-11-28-12-9-22/h4-7,14,18,20,25H,2-3,8-13H2,1H3,(H,21,24)/t18-/m1/s1
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n/an/a 2n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))		BDBM50084225
PNG
((R)-4-tert-Butoxyamino-1-(4-methoxy-benzenesulfony...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N1CC(C[C@@H]1C(=O)NO)NOC(C)(C)C
Show InChI InChI=1S/C16H25N3O6S/c1-16(2,3)25-18-11-9-14(15(20)17-21)19(10-11)26(22,23)13-7-5-12(24-4)6-8-13/h5-8,11,14,18,21H,9-10H2,1-4H3,(H,17,20)/t11?,14-/m1/s1
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n/an/a 3n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-3 (Matrix metalloproteinase-13)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084212
PNG
((R)-4-[(Z)-Methoxyimino]-1-(4-phenoxy-benzenesulfo...)
Show SMILES CO\N=C1\C[C@@H](N(C1)S(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)NO
Show InChI InChI=1S/C18H19N3O6S/c1-26-20-13-11-17(18(22)19-23)21(12-13)28(24,25)16-9-7-15(8-10-16)27-14-5-3-2-4-6-14/h2-10,17,23H,11-12H2,1H3,(H,19,22)/b20-13-/t17-/m1/s1
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n/an/a 3n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))		BDBM50084216
PNG
((R)-4-Methoxyamino-1-(4-methoxy-benzenesulfonyl)-p...)
Show SMILES CONC1C[C@@H](N(C1)S(=O)(=O)c1ccc(OC)cc1)C(=O)NO
Show InChI InChI=1S/C13H19N3O6S/c1-21-10-3-5-11(6-4-10)23(19,20)16-8-9(15-22-2)7-12(16)13(17)14-18/h3-6,9,12,15,18H,7-8H2,1-2H3,(H,14,17)/t9?,12-/m1/s1
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n/an/a 3n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-3 (Matrix metalloproteinase-13)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084205
PNG
((R)-1-[4-(4-Fluoro-phenoxy)-benzenesulfonyl]-4-[(Z...)
Show SMILES CO\N=C1\C[C@@H](N(C1)S(=O)(=O)c1ccc(Oc2ccc(F)cc2)cc1)C(=O)NO
Show InChI InChI=1S/C18H18FN3O6S/c1-27-21-13-10-17(18(23)20-24)22(11-13)29(25,26)16-8-6-15(7-9-16)28-14-4-2-12(19)3-5-14/h2-9,17,24H,10-11H2,1H3,(H,20,23)/b21-13-/t17-/m1/s1
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n/an/a 3n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))		BDBM50084204
PNG
((R)-1-(4-Methoxy-benzenesulfonyl)-4-[(Z)-methoxyim...)
Show SMILES CO\N=C1\C[C@@H](N(C1)S(=O)(=O)c1ccc(OC)cc1)C(=O)NO
Show InChI InChI=1S/C13H17N3O6S/c1-21-10-3-5-11(6-4-10)23(19,20)16-8-9(15-22-2)7-12(16)13(17)14-18/h3-6,12,18H,7-8H2,1-2H3,(H,14,17)/b15-9-/t12-/m1/s1
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n/an/a 3n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))		BDBM50084218
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-[(Z)-piperazin-...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C=C(C[C@@H]1C(=O)NO)NN1CCNCC1 |c:16|
Show InChI InChI=1S/C19H29N5O5S/c1-2-3-12-29-16-4-6-17(7-5-16)30(27,28)24-14-15(13-18(24)19(25)22-26)21-23-10-8-20-9-11-23/h4-7,14,18,20-21,26H,2-3,8-13H2,1H3,(H,22,25)/t18-/m1/s1
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n/an/a 3n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))		BDBM50084225
PNG
((R)-4-tert-Butoxyamino-1-(4-methoxy-benzenesulfony...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N1CC(C[C@@H]1C(=O)NO)NOC(C)(C)C
Show InChI InChI=1S/C16H25N3O6S/c1-16(2,3)25-18-11-9-14(15(20)17-21)19(10-11)26(22,23)13-7-5-12(24-4)6-8-13/h5-8,11,14,18,21H,9-10H2,1-4H3,(H,17,20)/t11?,14-/m1/s1
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n/an/a 4n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against gelatinase-A (matrix metalloproteinase-2).

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))		BDBM50084220
PNG
((R)-1-(4-Methoxy-benzenesulfonyl)-4-methylene-pyrr...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N1CC(=C)C[C@@H]1C(=O)NO
Show InChI InChI=1S/C13H16N2O5S/c1-9-7-12(13(16)14-17)15(8-9)21(18,19)11-5-3-10(20-2)4-6-11/h3-6,12,17H,1,7-8H2,2H3,(H,14,16)/t12-/m1/s1
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n/an/a 4n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-3 (Matrix metalloproteinase-13)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))		BDBM50084202
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-[(Z)-hydroxyimi...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C=C(C[C@@H]1C(=O)NO)NO |c:16|
Show InChI InChI=1S/C15H21N3O6S/c1-2-3-8-24-12-4-6-13(7-5-12)25(22,23)18-10-11(16-20)9-14(18)15(19)17-21/h4-7,10,14,16,20-21H,2-3,8-9H2,1H3,(H,17,19)/t14-/m1/s1
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n/an/a 5n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))		BDBM50084216
PNG
((R)-4-Methoxyamino-1-(4-methoxy-benzenesulfonyl)-p...)
Show SMILES CONC1C[C@@H](N(C1)S(=O)(=O)c1ccc(OC)cc1)C(=O)NO
Show InChI InChI=1S/C13H19N3O6S/c1-21-10-3-5-11(6-4-10)23(19,20)16-8-9(15-22-2)7-12(16)13(17)14-18/h3-6,9,12,15,18H,7-8H2,1-2H3,(H,14,17)/t9?,12-/m1/s1
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n/an/a 5n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against gelatinase-A (matrix metalloproteinase-2).

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))		BDBM50084222
PNG
((R)-4-[(Z)-Hydroxyimino]-1-(4-methoxy-benzenesulfo...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N1C=C(C[C@@H]1C(=O)NO)NO |c:13|
Show InChI InChI=1S/C12H15N3O6S/c1-21-9-2-4-10(5-3-9)22(19,20)15-7-8(13-17)6-11(15)12(16)14-18/h2-5,7,11,13,17-18H,6H2,1H3,(H,14,16)/t11-/m1/s1
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n/an/a 5n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))		BDBM50084215
PNG
((R)-4-[(Z)-tert-Butoxyimino]-1-[4-(pyridin-4-yloxy...)
Show SMILES CC(C)(C)O\N=C1\C[C@@H](N(C1)S(=O)(=O)c1ccc(Oc2ccncc2)cc1)C(=O)NO
Show InChI InChI=1S/C20H24N4O6S/c1-20(2,3)30-23-14-12-18(19(25)22-26)24(13-14)31(27,28)17-6-4-15(5-7-17)29-16-8-10-21-11-9-16/h4-11,18,26H,12-13H2,1-3H3,(H,22,25)/b23-14-/t18-/m1/s1
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n/an/a 5n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))		BDBM50084199
PNG
((R)-4-[(Z)-Phenoxyimino]-1-[4-(pyridin-4-yloxy)-be...)
Show SMILES ONC(=O)[C@H]1C\C(CN1S(=O)(=O)c1ccc(Oc2ccncc2)cc1)=N\Oc1ccccc1
Show InChI InChI=1S/C22H20N4O6S/c27-22(24-28)21-14-16(25-32-19-4-2-1-3-5-19)15-26(21)33(29,30)20-8-6-17(7-9-20)31-18-10-12-23-13-11-18/h1-13,21,28H,14-15H2,(H,24,27)/b25-16-/t21-/m1/s1
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n/an/a 5n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))		BDBM50084198
PNG
((R)-4-[(Z)-Methoxyimino]-1-[4-(pyridin-4-yloxy)-be...)
Show SMILES CO\N=C1\C[C@@H](N(C1)S(=O)(=O)c1ccc(Oc2ccncc2)cc1)C(=O)NO
Show InChI InChI=1S/C17H18N4O6S/c1-26-20-12-10-16(17(22)19-23)21(11-12)28(24,25)15-4-2-13(3-5-15)27-14-6-8-18-9-7-14/h2-9,16,23H,10-11H2,1H3,(H,19,22)/b20-12-/t16-/m1/s1
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n/an/a 5n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))		BDBM50084200
PNG
((R)-4-Methoxyamino-1-(4-phenoxy-benzenesulfonyl)-p...)
Show SMILES CONC1C[C@@H](N(C1)S(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)NO
Show InChI InChI=1S/C18H21N3O6S/c1-26-20-13-11-17(18(22)19-23)21(12-13)28(24,25)16-9-7-15(8-10-16)27-14-5-3-2-4-6-14/h2-10,13,17,20,23H,11-12H2,1H3,(H,19,22)/t13?,17-/m1/s1
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n/an/a 6n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))		BDBM50084214
PNG
((R)-4-Methoxyamino-1-[4-(2-methoxy-ethoxy)-benzene...)
Show SMILES COCCOc1ccc(cc1)S(=O)(=O)N1CC(C[C@@H]1C(=O)NO)NOC
Show InChI InChI=1S/C15H23N3O7S/c1-23-7-8-25-12-3-5-13(6-4-12)26(21,22)18-10-11(17-24-2)9-14(18)15(19)16-20/h3-6,11,14,17,20H,7-10H2,1-2H3,(H,16,19)/t11?,14-/m1/s1
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n/an/a 8n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-3 (Matrix metalloproteinase-13)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))		BDBM50084201
PNG
((R)-4-[(Z)-tert-Butoxyimino]-1-(4-methoxy-benzenes...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OC(C)(C)C
Show InChI InChI=1S/C16H23N3O6S/c1-16(2,3)25-18-11-9-14(15(20)17-21)19(10-11)26(22,23)13-7-5-12(24-4)6-8-13/h5-8,14,21H,9-10H2,1-4H3,(H,17,20)/b18-11-/t14-/m1/s1
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n/an/a 9n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))		BDBM50084210
PNG
((R)-1-[4-(2-Methoxy-ethoxy)-benzenesulfonyl]-4-met...)
Show SMILES COCCOc1ccc(cc1)S(=O)(=O)N1CC(=C)C[C@@H]1C(=O)NO
Show InChI InChI=1S/C15H20N2O6S/c1-11-9-14(15(18)16-19)17(10-11)24(20,21)13-5-3-12(4-6-13)23-8-7-22-2/h3-6,14,19H,1,7-10H2,2H3,(H,16,18)/t14-/m1/s1
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n/an/a 9n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against gelatinase-A (matrix metalloproteinase-2).

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084204
PNG
((R)-1-(4-Methoxy-benzenesulfonyl)-4-[(Z)-methoxyim...)
Show SMILES CO\N=C1\C[C@@H](N(C1)S(=O)(=O)c1ccc(OC)cc1)C(=O)NO
Show InChI InChI=1S/C13H17N3O6S/c1-21-10-3-5-11(6-4-10)23(19,20)16-8-9(15-22-2)7-12(16)13(17)14-18/h3-6,12,18H,7-8H2,1-2H3,(H,14,17)/b15-9-/t12-/m1/s1
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n/an/a 10n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))		BDBM50084214
PNG
((R)-4-Methoxyamino-1-[4-(2-methoxy-ethoxy)-benzene...)
Show SMILES COCCOc1ccc(cc1)S(=O)(=O)N1CC(C[C@@H]1C(=O)NO)NOC
Show InChI InChI=1S/C15H23N3O7S/c1-23-7-8-25-12-3-5-13(6-4-12)26(21,22)18-10-11(17-24-2)9-14(18)15(19)16-20/h3-6,11,14,17,20H,7-10H2,1-2H3,(H,16,19)/t11?,14-/m1/s1
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n/an/a 11n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against gelatinase-A (matrix metalloproteinase-2).

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))		BDBM50084210
PNG
((R)-1-[4-(2-Methoxy-ethoxy)-benzenesulfonyl]-4-met...)
Show SMILES COCCOc1ccc(cc1)S(=O)(=O)N1CC(=C)C[C@@H]1C(=O)NO
Show InChI InChI=1S/C15H20N2O6S/c1-11-9-14(15(18)16-19)17(10-11)24(20,21)13-5-3-12(4-6-13)23-8-7-22-2/h3-6,14,19H,1,7-10H2,2H3,(H,16,18)/t14-/m1/s1
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n/an/a 11n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-3 (Matrix metalloproteinase-13)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))		BDBM50084208
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-[(Z)-tert-butox...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OC(C)(C)C
Show InChI InChI=1S/C19H29N3O6S/c1-5-6-11-27-15-7-9-16(10-8-15)29(25,26)22-13-14(21-28-19(2,3)4)12-17(22)18(23)20-24/h7-10,17,24H,5-6,11-13H2,1-4H3,(H,20,23)/b21-14-/t17-/m1/s1
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n/an/a 11n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))		BDBM50084223
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-[(Z)-isobutoxyi...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OCC(C)C
Show InChI InChI=1S/C19H29N3O6S/c1-4-5-10-27-16-6-8-17(9-7-16)29(25,26)22-12-15(21-28-13-14(2)3)11-18(22)19(23)20-24/h6-9,14,18,24H,4-5,10-13H2,1-3H3,(H,20,23)/b21-15-/t18-/m1/s1
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n/an/a 12n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084221
PNG
((R)-4-[(Z)-Methoxyimino]-1-(4-propoxy-benzenesulfo...)
Show SMILES CCCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OC
Show InChI InChI=1S/C15H21N3O6S/c1-3-8-24-12-4-6-13(7-5-12)25(21,22)18-10-11(17-23-2)9-14(18)15(19)16-20/h4-7,14,20H,3,8-10H2,1-2H3,(H,16,19)/b17-11-/t14-/m1/s1
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n/an/a 13n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))		BDBM50084220
PNG
((R)-1-(4-Methoxy-benzenesulfonyl)-4-methylene-pyrr...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N1CC(=C)C[C@@H]1C(=O)NO
Show InChI InChI=1S/C13H16N2O5S/c1-9-7-12(13(16)14-17)15(8-9)21(18,19)11-5-3-10(20-2)4-6-11/h3-6,12,17H,1,7-8H2,2H3,(H,14,16)/t12-/m1/s1
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n/an/a 14n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))		BDBM50084217
PNG
((R)-4-Methylene-1-(4-phenoxy-benzenesulfonyl)-pyrr...)
Show SMILES ONC(=O)[C@H]1CC(=C)CN1S(=O)(=O)c1ccc(Oc2ccccc2)cc1
Show InChI InChI=1S/C18H18N2O5S/c1-13-11-17(18(21)19-22)20(12-13)26(23,24)16-9-7-15(8-10-16)25-14-5-3-2-4-6-14/h2-10,17,22H,1,11-12H2,(H,19,21)/t17-/m1/s1
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n/an/a 14n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084217
PNG
((R)-4-Methylene-1-(4-phenoxy-benzenesulfonyl)-pyrr...)
Show SMILES ONC(=O)[C@H]1CC(=C)CN1S(=O)(=O)c1ccc(Oc2ccccc2)cc1
Show InChI InChI=1S/C18H18N2O5S/c1-13-11-17(18(21)19-22)20(12-13)26(23,24)16-9-7-15(8-10-16)25-14-5-3-2-4-6-14/h2-10,17,22H,1,11-12H2,(H,19,21)/t17-/m1/s1
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n/an/a 15n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))		BDBM50084209
PNG
((R)-1-[4-(2-Methoxy-ethoxy)-benzenesulfonyl]-4-[(Z...)
Show SMILES COCCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OC
Show InChI InChI=1S/C15H21N3O7S/c1-23-7-8-25-12-3-5-13(6-4-12)26(21,22)18-10-11(17-24-2)9-14(18)15(19)16-20/h3-6,14,20H,7-10H2,1-2H3,(H,16,19)/b17-11-/t14-/m1/s1
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n/an/a 15n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))		BDBM50084197
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-methylene-pyrro...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1CC(=C)C[C@@H]1C(=O)NO
Show InChI InChI=1S/C16H22N2O5S/c1-3-4-9-23-13-5-7-14(8-6-13)24(21,22)18-11-12(2)10-15(18)16(19)17-20/h5-8,15,20H,2-4,9-11H2,1H3,(H,17,19)/t15-/m1/s1
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n/an/a 15n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))		BDBM50084226
PNG
((R)-1-(4-Ethoxy-benzenesulfonyl)-4-[(Z)-methoxyimi...)
Show SMILES CCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OC
Show InChI InChI=1S/C14H19N3O6S/c1-3-23-11-4-6-12(7-5-11)24(20,21)17-9-10(16-22-2)8-13(17)14(18)15-19/h4-7,13,19H,3,8-9H2,1-2H3,(H,15,18)/b16-10-/t13-/m1/s1
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n/an/a 16n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))		BDBM50084211
PNG
((R)-4-Methylene-1-(4-propoxy-benzenesulfonyl)-pyrr...)
Show SMILES CCCOc1ccc(cc1)S(=O)(=O)N1CC(=C)C[C@@H]1C(=O)NO
Show InChI InChI=1S/C15H20N2O5S/c1-3-8-22-12-4-6-13(7-5-12)23(20,21)17-10-11(2)9-14(17)15(18)16-19/h4-7,14,19H,2-3,8-10H2,1H3,(H,16,18)/t14-/m1/s1
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n/an/a 16n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084222
PNG
((R)-4-[(Z)-Hydroxyimino]-1-(4-methoxy-benzenesulfo...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N1C=C(C[C@@H]1C(=O)NO)NO |c:13|
Show InChI InChI=1S/C12H15N3O6S/c1-21-9-2-4-10(5-3-9)22(19,20)15-7-8(13-17)6-11(15)12(16)14-18/h2-5,7,11,13,17-18H,6H2,1H3,(H,14,16)/t11-/m1/s1
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n/an/a 17n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))		BDBM50084219
PNG
((R)-4-[(Z)-Benzyloxyimino]-1-(4-butoxy-benzenesulf...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OCc1ccccc1
Show InChI InChI=1S/C22H27N3O6S/c1-2-3-13-30-19-9-11-20(12-10-19)32(28,29)25-15-18(14-21(25)22(26)23-27)24-31-16-17-7-5-4-6-8-17/h4-12,21,27H,2-3,13-16H2,1H3,(H,23,26)/b24-18-/t21-/m1/s1
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n/an/a 17n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))		BDBM50084216
PNG
((R)-4-Methoxyamino-1-(4-methoxy-benzenesulfonyl)-p...)
Show SMILES CONC1C[C@@H](N(C1)S(=O)(=O)c1ccc(OC)cc1)C(=O)NO
Show InChI InChI=1S/C13H19N3O6S/c1-21-10-3-5-11(6-4-10)23(19,20)16-8-9(15-22-2)7-12(16)13(17)14-18/h3-6,9,12,15,18H,7-8H2,1-2H3,(H,14,17)/t9?,12-/m1/s1
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n/an/a 19n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Stromelysin-1


(Homo sapiens (Human))		BDBM50084225
PNG
((R)-4-tert-Butoxyamino-1-(4-methoxy-benzenesulfony...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N1CC(C[C@@H]1C(=O)NO)NOC(C)(C)C
Show InChI InChI=1S/C16H25N3O6S/c1-16(2,3)25-18-11-9-14(15(20)17-21)19(10-11)26(22,23)13-7-5-12(24-4)6-8-13/h5-8,11,14,18,21H,9-10H2,1-4H3,(H,17,20)/t11?,14-/m1/s1
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n/an/a 20n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084201
PNG
((R)-4-[(Z)-tert-Butoxyimino]-1-(4-methoxy-benzenes...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OC(C)(C)C
Show InChI InChI=1S/C16H23N3O6S/c1-16(2,3)25-18-11-9-14(15(20)17-21)19(10-11)26(22,23)13-7-5-12(24-4)6-8-13/h5-8,14,21H,9-10H2,1-4H3,(H,17,20)/b18-11-/t14-/m1/s1
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n/an/a 20n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))		BDBM50084213
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-methoxyamino-py...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1CC(C[C@@H]1C(=O)NO)NOC
Show InChI InChI=1S/C16H25N3O6S/c1-3-4-9-25-13-5-7-14(8-6-13)26(22,23)19-11-12(18-24-2)10-15(19)16(20)17-21/h5-8,12,15,18,21H,3-4,9-11H2,1-2H3,(H,17,20)/t12?,15-/m1/s1
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n/an/a 21n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084226
PNG
((R)-1-(4-Ethoxy-benzenesulfonyl)-4-[(Z)-methoxyimi...)
Show SMILES CCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OC
Show InChI InChI=1S/C14H19N3O6S/c1-3-23-11-4-6-12(7-5-11)24(20,21)17-9-10(16-22-2)8-13(17)14(18)15-19/h4-7,13,19H,3,8-9H2,1-2H3,(H,15,18)/b16-10-/t13-/m1/s1
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n/an/a 22n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084207
PNG
((R)-4-[(Z)-tert-Butoxyimino]-1-[4-(4-fluoro-phenox...)
Show SMILES CC(C)(C)O\N=C1\C[C@@H](N(C1)S(=O)(=O)c1ccc(Oc2ccc(F)cc2)cc1)C(=O)NO
Show InChI InChI=1S/C21H24FN3O6S/c1-21(2,3)31-24-15-12-19(20(26)23-27)25(13-15)32(28,29)18-10-8-17(9-11-18)30-16-6-4-14(22)5-7-16/h4-11,19,27H,12-13H2,1-3H3,(H,23,26)/b24-15-/t19-/m1/s1
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n/an/a 24n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084206
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-[(Z)-methoxyimi...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OC
Show InChI InChI=1S/C16H23N3O6S/c1-3-4-9-25-13-5-7-14(8-6-13)26(22,23)19-11-12(18-24-2)10-15(19)16(20)17-21/h5-8,15,21H,3-4,9-11H2,1-2H3,(H,17,20)/b18-12-/t15-/m1/s1
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n/an/a 26n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084215
PNG
((R)-4-[(Z)-tert-Butoxyimino]-1-[4-(pyridin-4-yloxy...)
Show SMILES CC(C)(C)O\N=C1\C[C@@H](N(C1)S(=O)(=O)c1ccc(Oc2ccncc2)cc1)C(=O)NO
Show InChI InChI=1S/C20H24N4O6S/c1-20(2,3)30-23-14-12-18(19(25)22-26)24(13-14)31(27,28)17-6-4-15(5-7-17)29-16-8-10-21-11-9-16/h4-11,18,26H,12-13H2,1-3H3,(H,22,25)/b23-14-/t18-/m1/s1
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n/an/a 26n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084199
PNG
((R)-4-[(Z)-Phenoxyimino]-1-[4-(pyridin-4-yloxy)-be...)
Show SMILES ONC(=O)[C@H]1C\C(CN1S(=O)(=O)c1ccc(Oc2ccncc2)cc1)=N\Oc1ccccc1
Show InChI InChI=1S/C22H20N4O6S/c27-22(24-28)21-14-16(25-32-19-4-2-1-3-5-19)15-26(21)33(29,30)20-8-6-17(7-9-20)31-18-10-12-23-13-11-18/h1-13,21,28H,14-15H2,(H,24,27)/b25-16-/t21-/m1/s1
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n/an/a 32n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084203
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-[(Z)-ethoxyimin...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OCC
Show InChI InChI=1S/C17H25N3O6S/c1-3-5-10-25-14-6-8-15(9-7-14)27(23,24)20-12-13(19-26-4-2)11-16(20)17(21)18-22/h6-9,16,22H,3-5,10-12H2,1-2H3,(H,18,21)/b19-13-/t16-/m1/s1
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n/an/a 39n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))		BDBM50084203
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-[(Z)-ethoxyimin...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OCC
Show InChI InChI=1S/C17H25N3O6S/c1-3-5-10-25-14-6-8-15(9-7-14)27(23,24)20-12-13(19-26-4-2)11-16(20)17(21)18-22/h6-9,16,22H,3-5,10-12H2,1-2H3,(H,18,21)/b19-13-/t16-/m1/s1
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n/an/a 39n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))		BDBM50084217
PNG
((R)-4-Methylene-1-(4-phenoxy-benzenesulfonyl)-pyrr...)
Show SMILES ONC(=O)[C@H]1CC(=C)CN1S(=O)(=O)c1ccc(Oc2ccccc2)cc1
Show InChI InChI=1S/C18H18N2O5S/c1-13-11-17(18(21)19-22)20(12-13)26(23,24)16-9-7-15(8-10-16)25-14-5-3-2-4-6-14/h2-10,17,22H,1,11-12H2,(H,19,21)/t17-/m1/s1
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n/an/a 53n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))		BDBM50084212
PNG
((R)-4-[(Z)-Methoxyimino]-1-(4-phenoxy-benzenesulfo...)
Show SMILES CO\N=C1\C[C@@H](N(C1)S(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)NO
Show InChI InChI=1S/C18H19N3O6S/c1-26-20-13-11-17(18(22)19-23)21(12-13)28(24,25)16-9-7-15(8-10-16)27-14-5-3-2-4-6-14/h2-10,17,23H,11-12H2,1H3,(H,19,22)/b20-13-/t17-/m1/s1
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n/an/a 60n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))		BDBM50084210
PNG
((R)-1-[4-(2-Methoxy-ethoxy)-benzenesulfonyl]-4-met...)
Show SMILES COCCOc1ccc(cc1)S(=O)(=O)N1CC(=C)C[C@@H]1C(=O)NO
Show InChI InChI=1S/C15H20N2O6S/c1-11-9-14(15(18)16-19)17(10-11)24(20,21)13-5-3-12(4-6-13)23-8-7-22-2/h3-6,14,19H,1,7-10H2,2H3,(H,16,18)/t14-/m1/s1
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n/an/a 69n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084208
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-[(Z)-tert-butox...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OC(C)(C)C
Show InChI InChI=1S/C19H29N3O6S/c1-5-6-11-27-15-7-9-16(10-8-15)29(25,26)22-13-14(21-28-19(2,3)4)12-17(22)18(23)20-24/h7-10,17,24H,5-6,11-13H2,1-4H3,(H,20,23)/b21-14-/t17-/m1/s1
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n/an/a 74n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084223
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-[(Z)-isobutoxyi...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OCC(C)C
Show InChI InChI=1S/C19H29N3O6S/c1-4-5-10-27-16-6-8-17(9-7-16)29(25,26)22-12-15(21-28-13-14(2)3)11-18(22)19(23)20-24/h6-9,14,18,24H,4-5,10-13H2,1-3H3,(H,20,23)/b21-15-/t18-/m1/s1
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n/an/a 75n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084198
PNG
((R)-4-[(Z)-Methoxyimino]-1-[4-(pyridin-4-yloxy)-be...)
Show SMILES CO\N=C1\C[C@@H](N(C1)S(=O)(=O)c1ccc(Oc2ccncc2)cc1)C(=O)NO
Show InChI InChI=1S/C17H18N4O6S/c1-26-20-12-10-16(17(22)19-23)21(11-12)28(24,25)15-4-2-13(3-5-15)27-14-6-8-18-9-7-14/h2-9,16,23H,10-11H2,1H3,(H,19,22)/b20-12-/t16-/m1/s1
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n/an/a 81n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))		BDBM50084204
PNG
((R)-1-(4-Methoxy-benzenesulfonyl)-4-[(Z)-methoxyim...)
Show SMILES CO\N=C1\C[C@@H](N(C1)S(=O)(=O)c1ccc(OC)cc1)C(=O)NO
Show InChI InChI=1S/C13H17N3O6S/c1-21-10-3-5-11(6-4-10)23(19,20)16-8-9(15-22-2)7-12(16)13(17)14-18/h3-6,12,18H,7-8H2,1-2H3,(H,14,17)/b15-9-/t12-/m1/s1
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n/an/a 82n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084200
PNG
((R)-4-Methoxyamino-1-(4-phenoxy-benzenesulfonyl)-p...)
Show SMILES CONC1C[C@@H](N(C1)S(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)NO
Show InChI InChI=1S/C18H21N3O6S/c1-26-20-13-11-17(18(22)19-23)21(12-13)28(24,25)16-9-7-15(8-10-16)27-14-5-3-2-4-6-14/h2-10,13,17,20,23H,11-12H2,1H3,(H,19,22)/t13?,17-/m1/s1
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n/an/a 86n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))		BDBM50084206
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-[(Z)-methoxyimi...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OC
Show InChI InChI=1S/C16H23N3O6S/c1-3-4-9-25-13-5-7-14(8-6-13)26(22,23)19-11-12(18-24-2)10-15(19)16(20)17-21/h5-8,15,21H,3-4,9-11H2,1-2H3,(H,17,20)/b18-12-/t15-/m1/s1
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n/an/a 89n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084220
PNG
((R)-1-(4-Methoxy-benzenesulfonyl)-4-methylene-pyrr...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N1CC(=C)C[C@@H]1C(=O)NO
Show InChI InChI=1S/C13H16N2O5S/c1-9-7-12(13(16)14-17)15(8-9)21(18,19)11-5-3-10(20-2)4-6-11/h3-6,12,17H,1,7-8H2,2H3,(H,14,16)/t12-/m1/s1
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n/an/a 90n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084209
PNG
((R)-1-[4-(2-Methoxy-ethoxy)-benzenesulfonyl]-4-[(Z...)
Show SMILES COCCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OC
Show InChI InChI=1S/C15H21N3O7S/c1-23-7-8-25-12-3-5-13(6-4-12)26(21,22)18-10-11(17-24-2)9-14(18)15(19)16-20/h3-6,14,20H,7-10H2,1-2H3,(H,16,19)/b17-11-/t14-/m1/s1
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n/an/a 109n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084202
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-[(Z)-hydroxyimi...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C=C(C[C@@H]1C(=O)NO)NO |c:16|
Show InChI InChI=1S/C15H21N3O6S/c1-2-3-8-24-12-4-6-13(7-5-12)25(22,23)18-10-11(16-20)9-14(18)15(19)17-21/h4-7,10,14,16,20-21H,2-3,8-9H2,1H3,(H,17,19)/t14-/m1/s1
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n/an/a 119n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084219
PNG
((R)-4-[(Z)-Benzyloxyimino]-1-(4-butoxy-benzenesulf...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OCc1ccccc1
Show InChI InChI=1S/C22H27N3O6S/c1-2-3-13-30-19-9-11-20(12-10-19)32(28,29)25-15-18(14-21(25)22(26)23-27)24-31-16-17-7-5-4-6-8-17/h4-12,21,27H,2-3,13-16H2,1H3,(H,23,26)/b24-18-/t21-/m1/s1
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n/an/a 127n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084211
PNG
((R)-4-Methylene-1-(4-propoxy-benzenesulfonyl)-pyrr...)
Show SMILES CCCOc1ccc(cc1)S(=O)(=O)N1CC(=C)C[C@@H]1C(=O)NO
Show InChI InChI=1S/C15H20N2O5S/c1-3-8-22-12-4-6-13(7-5-12)23(20,21)17-10-11(2)9-14(17)15(18)16-19/h4-7,14,19H,2-3,8-10H2,1H3,(H,16,18)/t14-/m1/s1
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n/an/a 155n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084218
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-[(Z)-piperazin-...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C=C(C[C@@H]1C(=O)NO)NN1CCNCC1 |c:16|
Show InChI InChI=1S/C19H29N5O5S/c1-2-3-12-29-16-4-6-17(7-5-16)30(27,28)24-14-15(13-18(24)19(25)22-26)21-23-10-8-20-9-11-23/h4-7,14,18,20-21,26H,2-3,8-13H2,1H3,(H,22,25)/t18-/m1/s1
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n/an/a 184n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))		BDBM50084224
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-[(Z)-morpholin-...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C=C(C[C@@H]1C(=O)NO)NN1CCOCC1 |c:16|
Show InChI InChI=1S/C19H28N4O6S/c1-2-3-10-29-16-4-6-17(7-5-16)30(26,27)23-14-15(13-18(23)19(24)21-25)20-22-8-11-28-12-9-22/h4-7,14,18,20,25H,2-3,8-13H2,1H3,(H,21,24)/t18-/m1/s1
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n/an/a 196n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084216
PNG
((R)-4-Methoxyamino-1-(4-methoxy-benzenesulfonyl)-p...)
Show SMILES CONC1C[C@@H](N(C1)S(=O)(=O)c1ccc(OC)cc1)C(=O)NO
Show InChI InChI=1S/C13H19N3O6S/c1-21-10-3-5-11(6-4-10)23(19,20)16-8-9(15-22-2)7-12(16)13(17)14-18/h3-6,9,12,15,18H,7-8H2,1-2H3,(H,14,17)/t9?,12-/m1/s1
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n/an/a 212n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))		BDBM50084214
PNG
((R)-4-Methoxyamino-1-[4-(2-methoxy-ethoxy)-benzene...)
Show SMILES COCCOc1ccc(cc1)S(=O)(=O)N1CC(C[C@@H]1C(=O)NO)NOC
Show InChI InChI=1S/C15H23N3O7S/c1-23-7-8-25-12-3-5-13(6-4-12)26(21,22)18-10-11(17-24-2)9-14(18)15(19)16-20/h3-6,11,14,17,20H,7-10H2,1-2H3,(H,16,19)/t11?,14-/m1/s1
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n/an/a 222n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084225
PNG
((R)-4-tert-Butoxyamino-1-(4-methoxy-benzenesulfony...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N1CC(C[C@@H]1C(=O)NO)NOC(C)(C)C
Show InChI InChI=1S/C16H25N3O6S/c1-16(2,3)25-18-11-9-14(15(20)17-21)19(10-11)26(22,23)13-7-5-12(24-4)6-8-13/h5-8,11,14,18,21H,9-10H2,1-4H3,(H,17,20)/t11?,14-/m1/s1
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n/an/a 255n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))		BDBM50084201
PNG
((R)-4-[(Z)-tert-Butoxyimino]-1-(4-methoxy-benzenes...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OC(C)(C)C
Show InChI InChI=1S/C16H23N3O6S/c1-16(2,3)25-18-11-9-14(15(20)17-21)19(10-11)26(22,23)13-7-5-12(24-4)6-8-13/h5-8,14,21H,9-10H2,1-4H3,(H,17,20)/b18-11-/t14-/m1/s1
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n/an/a 263n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084224
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-[(Z)-morpholin-...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C=C(C[C@@H]1C(=O)NO)NN1CCOCC1 |c:16|
Show InChI InChI=1S/C19H28N4O6S/c1-2-3-10-29-16-4-6-17(7-5-16)30(26,27)23-14-15(13-18(23)19(24)21-25)20-22-8-11-28-12-9-22/h4-7,14,18,20,25H,2-3,8-13H2,1H3,(H,21,24)/t18-/m1/s1
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n/an/a 293n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))		BDBM50084208
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-[(Z)-tert-butox...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OC(C)(C)C
Show InChI InChI=1S/C19H29N3O6S/c1-5-6-11-27-15-7-9-16(10-8-15)29(25,26)22-13-14(21-28-19(2,3)4)12-17(22)18(23)20-24/h7-10,17,24H,5-6,11-13H2,1-4H3,(H,20,23)/b21-14-/t17-/m1/s1
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n/an/a 294n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))		BDBM50084202
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-[(Z)-hydroxyimi...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C=C(C[C@@H]1C(=O)NO)NO |c:16|
Show InChI InChI=1S/C15H21N3O6S/c1-2-3-8-24-12-4-6-13(7-5-12)25(22,23)18-10-11(16-20)9-14(18)15(19)17-21/h4-7,10,14,16,20-21H,2-3,8-9H2,1H3,(H,17,19)/t14-/m1/s1
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n/an/a 307n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084197
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-methylene-pyrro...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1CC(=C)C[C@@H]1C(=O)NO
Show InChI InChI=1S/C16H22N2O5S/c1-3-4-9-23-13-5-7-14(8-6-13)24(21,22)18-11-12(2)10-15(18)16(19)17-20/h5-8,15,20H,2-4,9-11H2,1H3,(H,17,19)/t15-/m1/s1
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n/an/a 329n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))		BDBM50084218
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-[(Z)-piperazin-...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C=C(C[C@@H]1C(=O)NO)NN1CCNCC1 |c:16|
Show InChI InChI=1S/C19H29N5O5S/c1-2-3-12-29-16-4-6-17(7-5-16)30(27,28)24-14-15(13-18(24)19(25)22-26)21-23-10-8-20-9-11-23/h4-7,14,18,20-21,26H,2-3,8-13H2,1H3,(H,22,25)/t18-/m1/s1
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n/an/a 343n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))		BDBM50084221
PNG
((R)-4-[(Z)-Methoxyimino]-1-(4-propoxy-benzenesulfo...)
Show SMILES CCCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OC
Show InChI InChI=1S/C15H21N3O6S/c1-3-8-24-12-4-6-13(7-5-12)25(21,22)18-10-11(17-23-2)9-14(18)15(19)16-20/h4-7,14,20H,3,8-10H2,1-2H3,(H,16,19)/b17-11-/t14-/m1/s1
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n/an/a 381n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))		BDBM50084223
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-[(Z)-isobutoxyi...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OCC(C)C
Show InChI InChI=1S/C19H29N3O6S/c1-4-5-10-27-16-6-8-17(9-7-16)29(25,26)22-12-15(21-28-13-14(2)3)11-18(22)19(23)20-24/h6-9,14,18,24H,4-5,10-13H2,1-3H3,(H,20,23)/b21-15-/t18-/m1/s1
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n/an/a 420n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))		BDBM50084219
PNG
((R)-4-[(Z)-Benzyloxyimino]-1-(4-butoxy-benzenesulf...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OCc1ccccc1
Show InChI InChI=1S/C22H27N3O6S/c1-2-3-13-30-19-9-11-20(12-10-19)32(28,29)25-15-18(14-21(25)22(26)23-27)24-31-16-17-7-5-4-6-8-17/h4-12,21,27H,2-3,13-16H2,1H3,(H,23,26)/b24-18-/t21-/m1/s1
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n/an/a 490n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))		BDBM50084209
PNG
((R)-1-[4-(2-Methoxy-ethoxy)-benzenesulfonyl]-4-[(Z...)
Show SMILES COCCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OC
Show InChI InChI=1S/C15H21N3O7S/c1-23-7-8-25-12-3-5-13(6-4-12)26(21,22)18-10-11(17-24-2)9-14(18)15(19)16-20/h3-6,14,20H,7-10H2,1-2H3,(H,16,19)/b17-11-/t14-/m1/s1
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n/an/a 612n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))		BDBM50084215
PNG
((R)-4-[(Z)-tert-Butoxyimino]-1-[4-(pyridin-4-yloxy...)
Show SMILES CC(C)(C)O\N=C1\C[C@@H](N(C1)S(=O)(=O)c1ccc(Oc2ccncc2)cc1)C(=O)NO
Show InChI InChI=1S/C20H24N4O6S/c1-20(2,3)30-23-14-12-18(19(25)22-26)24(13-14)31(27,28)17-6-4-15(5-7-17)29-16-8-10-21-11-9-16/h4-11,18,26H,12-13H2,1-3H3,(H,22,25)/b23-14-/t18-/m1/s1
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n/an/a 785n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))		BDBM50084199
PNG
((R)-4-[(Z)-Phenoxyimino]-1-[4-(pyridin-4-yloxy)-be...)
Show SMILES ONC(=O)[C@H]1C\C(CN1S(=O)(=O)c1ccc(Oc2ccncc2)cc1)=N\Oc1ccccc1
Show InChI InChI=1S/C22H20N4O6S/c27-22(24-28)21-14-16(25-32-19-4-2-1-3-5-19)15-26(21)33(29,30)20-8-6-17(7-9-20)31-18-10-12-23-13-11-18/h1-13,21,28H,14-15H2,(H,24,27)/b25-16-/t21-/m1/s1
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n/an/a 785n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084213
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-methoxyamino-py...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1CC(C[C@@H]1C(=O)NO)NOC
Show InChI InChI=1S/C16H25N3O6S/c1-3-4-9-25-13-5-7-14(8-6-13)26(22,23)19-11-12(18-24-2)10-15(19)16(20)17-21/h5-8,12,15,18,21H,3-4,9-11H2,1-2H3,(H,17,20)/t12?,15-/m1/s1
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n/an/a 790n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))		BDBM50084198
PNG
((R)-4-[(Z)-Methoxyimino]-1-[4-(pyridin-4-yloxy)-be...)
Show SMILES CO\N=C1\C[C@@H](N(C1)S(=O)(=O)c1ccc(Oc2ccncc2)cc1)C(=O)NO
Show InChI InChI=1S/C17H18N4O6S/c1-26-20-12-10-16(17(22)19-23)21(11-12)28(24,25)15-4-2-13(3-5-15)27-14-6-8-18-9-7-14/h2-9,16,23H,10-11H2,1H3,(H,19,22)/b20-12-/t16-/m1/s1
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n/an/a 922n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))		BDBM50084207
PNG
((R)-4-[(Z)-tert-Butoxyimino]-1-[4-(4-fluoro-phenox...)
Show SMILES CC(C)(C)O\N=C1\C[C@@H](N(C1)S(=O)(=O)c1ccc(Oc2ccc(F)cc2)cc1)C(=O)NO
Show InChI InChI=1S/C21H24FN3O6S/c1-21(2,3)31-24-15-12-19(20(26)23-27)25(13-15)32(28,29)18-10-8-17(9-11-18)30-16-6-4-14(22)5-7-16/h4-11,19,27H,12-13H2,1-3H3,(H,23,26)/b24-15-/t19-/m1/s1
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n/an/a 1.03E+3n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))		BDBM50084226
PNG
((R)-1-(4-Ethoxy-benzenesulfonyl)-4-[(Z)-methoxyimi...)
Show SMILES CCOc1ccc(cc1)S(=O)(=O)N1C\C(C[C@@H]1C(=O)NO)=N/OC
Show InChI InChI=1S/C14H19N3O6S/c1-3-23-11-4-6-12(7-5-11)24(20,21)17-9-10(16-22-2)8-13(17)14(18)15-19/h4-7,13,19H,3,8-9H2,1-2H3,(H,15,18)/b16-10-/t13-/m1/s1
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n/an/a 1.06E+3n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))		BDBM50084197
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-methylene-pyrro...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1CC(=C)C[C@@H]1C(=O)NO
Show InChI InChI=1S/C16H22N2O5S/c1-3-4-9-23-13-5-7-14(8-6-13)24(21,22)18-11-12(2)10-15(18)16(19)17-20/h5-8,15,20H,2-4,9-11H2,1H3,(H,17,19)/t15-/m1/s1
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n/an/a 1.08E+3n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084210
PNG
((R)-1-[4-(2-Methoxy-ethoxy)-benzenesulfonyl]-4-met...)
Show SMILES COCCOc1ccc(cc1)S(=O)(=O)N1CC(=C)C[C@@H]1C(=O)NO
Show InChI InChI=1S/C15H20N2O6S/c1-11-9-14(15(18)16-19)17(10-11)24(20,21)13-5-3-12(4-6-13)23-8-7-22-2/h3-6,14,19H,1,7-10H2,2H3,(H,16,18)/t14-/m1/s1
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n/an/a 1.55E+3n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))		BDBM50084200
PNG
((R)-4-Methoxyamino-1-(4-phenoxy-benzenesulfonyl)-p...)
Show SMILES CONC1C[C@@H](N(C1)S(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)NO
Show InChI InChI=1S/C18H21N3O6S/c1-26-20-13-11-17(18(22)19-23)21(12-13)28(24,25)16-9-7-15(8-10-16)27-14-5-3-2-4-6-14/h2-10,13,17,20,23H,11-12H2,1H3,(H,19,22)/t13?,17-/m1/s1
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n/an/a 1.79E+3n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))		BDBM50084213
PNG
((R)-1-(4-Butoxy-benzenesulfonyl)-4-methoxyamino-py...)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1CC(C[C@@H]1C(=O)NO)NOC
Show InChI InChI=1S/C16H25N3O6S/c1-3-4-9-25-13-5-7-14(8-6-13)26(22,23)19-11-12(18-24-2)10-15(19)16(20)17-21/h5-8,12,15,18,21H,3-4,9-11H2,1-2H3,(H,17,20)/t12?,15-/m1/s1
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n/an/a 2.08E+3n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))		BDBM50084211
PNG
((R)-4-Methylene-1-(4-propoxy-benzenesulfonyl)-pyrr...)
Show SMILES CCCOc1ccc(cc1)S(=O)(=O)N1CC(=C)C[C@@H]1C(=O)NO
Show InChI InChI=1S/C15H20N2O5S/c1-3-8-22-12-4-6-13(7-5-12)23(20,21)17-10-11(2)9-14(17)15(18)16-19/h4-7,14,19H,2-3,8-10H2,1H3,(H,16,18)/t14-/m1/s1
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n/an/a 2.55E+3n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))		BDBM50084216
PNG
((R)-4-Methoxyamino-1-(4-methoxy-benzenesulfonyl)-p...)
Show SMILES CONC1C[C@@H](N(C1)S(=O)(=O)c1ccc(OC)cc1)C(=O)NO
Show InChI InChI=1S/C13H19N3O6S/c1-21-10-3-5-11(6-4-10)23(19,20)16-8-9(15-22-2)7-12(16)13(17)14-18/h3-6,9,12,15,18H,7-8H2,1-2H3,(H,14,17)/t9?,12-/m1/s1
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n/an/a 3.39E+3n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))		BDBM50084214
PNG
((R)-4-Methoxyamino-1-[4-(2-methoxy-ethoxy)-benzene...)
Show SMILES COCCOc1ccc(cc1)S(=O)(=O)N1CC(C[C@@H]1C(=O)NO)NOC
Show InChI InChI=1S/C15H23N3O7S/c1-23-7-8-25-12-3-5-13(6-4-12)26(21,22)18-10-11(17-24-2)9-14(18)15(19)16-20/h3-6,11,14,17,20H,7-10H2,1-2H3,(H,16,19)/t11?,14-/m1/s1
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n/an/a 4.24E+3n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))		BDBM50084225
PNG
((R)-4-tert-Butoxyamino-1-(4-methoxy-benzenesulfony...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N1CC(C[C@@H]1C(=O)NO)NOC(C)(C)C
Show InChI InChI=1S/C16H25N3O6S/c1-16(2,3)25-18-11-9-14(15(20)17-21)19(10-11)26(22,23)13-7-5-12(24-4)6-8-13/h5-8,11,14,18,21H,9-10H2,1-4H3,(H,17,20)/t11?,14-/m1/s1
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n/an/a 5.24E+3n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))		BDBM50084214
PNG
((R)-4-Methoxyamino-1-[4-(2-methoxy-ethoxy)-benzene...)
Show SMILES COCCOc1ccc(cc1)S(=O)(=O)N1CC(C[C@@H]1C(=O)NO)NOC
Show InChI InChI=1S/C15H23N3O7S/c1-23-7-8-25-12-3-5-13(6-4-12)26(21,22)18-10-11(17-24-2)9-14(18)15(19)16-20/h3-6,11,14,17,20H,7-10H2,1-2H3,(H,16,19)/t11?,14-/m1/s1
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n/an/a 6.72E+3n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))		BDBM50084210
PNG
((R)-1-[4-(2-Methoxy-ethoxy)-benzenesulfonyl]-4-met...)
Show SMILES COCCOc1ccc(cc1)S(=O)(=O)N1CC(=C)C[C@@H]1C(=O)NO
Show InChI InChI=1S/C15H20N2O6S/c1-11-9-14(15(18)16-19)17(10-11)24(20,21)13-5-3-12(4-6-13)23-8-7-22-2/h3-6,14,19H,1,7-10H2,2H3,(H,16,18)/t14-/m1/s1
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n/an/a>9.99E+3n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))		BDBM50084220
PNG
((R)-1-(4-Methoxy-benzenesulfonyl)-4-methylene-pyrr...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N1CC(=C)C[C@@H]1C(=O)NO
Show InChI InChI=1S/C13H16N2O5S/c1-9-7-12(13(16)14-17)15(8-9)21(18,19)11-5-3-10(20-2)4-6-11/h3-6,12,17H,1,7-8H2,2H3,(H,14,16)/t12-/m1/s1
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n/an/a 1.23E+4n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)

J Med Chem 42: 5426-36 (2000)


BindingDB Entry DOI: 10.7270/Q2Q23ZGT
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%