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PubMed code 11754593

Compile data set for download or QSAR
Found 148 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


(homo sapiens (human))
BDBM50082556
PNG
((S)-2,2-Dimethyl-4-[4-(pyridin-4-yloxy)-benzenesul...)
Show SMILES CC1(C)SCCN([C@H]1C(=O)NO)S(=O)(=O)c1ccc(Oc2ccncc2)cc1
Show InChI InChI=1S/C18H21N3O5S2/c1-18(2)16(17(22)20-23)21(11-12-27-18)28(24,25)15-5-3-13(4-6-15)26-14-7-9-19-10-8-14/h3-10,16,23H,11-12H2,1-2H3,(H,20,22)/t16-/m0/s1
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n/an/a 0.0480n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50082556
PNG
((S)-2,2-Dimethyl-4-[4-(pyridin-4-yloxy)-benzenesul...)
Show SMILES CC1(C)SCCN([C@H]1C(=O)NO)S(=O)(=O)c1ccc(Oc2ccncc2)cc1
Show InChI InChI=1S/C18H21N3O5S2/c1-18(2)16(17(22)20-23)21(11-12-27-18)28(24,25)15-5-3-13(4-6-15)26-14-7-9-19-10-8-14/h3-10,16,23H,11-12H2,1-2H3,(H,20,22)/t16-/m0/s1
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n/an/a 0.0480n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108151
PNG
(CHEMBL75164 | N-{2,3-Dihydroxy-1-[4-(4-trifluorome...)
Show SMILES OC[C@@H](O)C(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C18H18F3NO8S/c19-18(20,21)30-14-3-1-12(2-4-14)29-13-5-7-15(8-6-13)31(27,28)10-16(17(25)9-23)22(26)11-24/h1-8,11,16-17,23,25-26H,9-10H2/t16?,17-/m1/s1
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n/an/a 0.0920n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108135
PNG
(2-(Formyl-hydroxy-amino)-3-[4-(4-trifluoromethoxy-...)
Show SMILES CN(C)S(=O)(=O)CC(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C19H21F3N2O8S2/c1-23(2)34(29,30)12-14(24(26)13-25)11-33(27,28)18-9-7-16(8-10-18)31-15-3-5-17(6-4-15)32-19(20,21)22/h3-10,13-14,26H,11-12H2,1-2H3
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n/an/a 0.0980n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (human))
BDBM50082556
PNG
((S)-2,2-Dimethyl-4-[4-(pyridin-4-yloxy)-benzenesul...)
Show SMILES CC1(C)SCCN([C@H]1C(=O)NO)S(=O)(=O)c1ccc(Oc2ccncc2)cc1
Show InChI InChI=1S/C18H21N3O5S2/c1-18(2)16(17(22)20-23)21(11-12-27-18)28(24,25)15-5-3-13(4-6-15)26-14-7-9-19-10-8-14/h3-10,16,23H,11-12H2,1-2H3,(H,20,22)/t16-/m0/s1
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n/an/a 0.200n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Matrix metalloprotease-13 (MMP-13) in fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108131
PNG
(CHEMBL307413 | N-Hydroxy-N-{1-hydroxymethyl-2-[4-(...)
Show SMILES OCC(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C17H16F3NO7S/c18-17(19,20)28-15-3-1-13(2-4-15)27-14-5-7-16(8-6-14)29(25,26)10-12(9-22)21(24)11-23/h1-8,11-12,22,24H,9-10H2
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n/an/a 0.260n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108163
PNG
(CHEMBL309329 | N-Hydroxy-N-{1-(2-hydroxy-ethoxymet...)
Show SMILES OCCOCC(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C19H20F3NO8S/c20-19(21,22)31-17-3-1-15(2-4-17)30-16-5-7-18(8-6-16)32(27,28)12-14(23(26)13-25)11-29-10-9-24/h1-8,13-14,24,26H,9-12H2
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n/an/a 0.300n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108159
PNG
(CHEMBL75302 | N-[2-[4-(4-Chloro-phenoxy)-benzenesu...)
Show SMILES CC1(C)NC(=O)N(CC(CS(=O)(=O)c2ccc(Oc3ccc(Cl)cc3)cc2)N(O)C=O)C1=O
Show InChI InChI=1S/C21H22ClN3O7S/c1-21(2)19(27)24(20(28)23-21)11-15(25(29)13-26)12-33(30,31)18-9-7-17(8-10-18)32-16-5-3-14(22)4-6-16/h3-10,13,15,29H,11-12H2,1-2H3,(H,23,28)
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n/an/a 0.320n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108147
PNG
(CHEMBL75114 | N-Hydroxy-N-{1-(tetrahydro-furan-2-y...)
Show SMILES ON(C=O)C(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)C1CCCO1
Show InChI InChI=1S/C20H20F3NO7S/c21-20(22,23)31-16-5-3-14(4-6-16)30-15-7-9-17(10-8-15)32(27,28)12-18(24(26)13-25)19-2-1-11-29-19/h3-10,13,18-19,26H,1-2,11-12H2
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n/an/a 0.320n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108138
PNG
(CHEMBL78052 | N-Hydroxy-N-{3-(4-methanesulfonyl-pi...)
Show SMILES CS(=O)(=O)N1CCN(CCC(CS(=O)(=O)c2ccc(Oc3ccc(OC(F)(F)F)cc3)cc2)N(O)C=O)CC1
Show InChI InChI=1S/C23H28F3N3O8S2/c1-38(32,33)28-14-12-27(13-15-28)11-10-18(29(31)17-30)16-39(34,35)22-8-6-20(7-9-22)36-19-2-4-21(5-3-19)37-23(24,25)26/h2-9,17-18,31H,10-16H2,1H3
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n/an/a 0.330n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108166
PNG
(CHEMBL76043 | N-[1-(5,5-Dimethyl-2,4-dioxo-imidazo...)
Show SMILES CC1(C)N(CC(CS(=O)(=O)c2ccc(cc2)-c2ccc(OC(F)(F)F)cc2)N(O)C=O)C(=O)NC1=O
Show InChI InChI=1S/C22H22F3N3O7S/c1-21(2)19(30)26-20(31)27(21)11-16(28(32)13-29)12-36(33,34)18-9-5-15(6-10-18)14-3-7-17(8-4-14)35-22(23,24)25/h3-10,13,16,32H,11-12H2,1-2H3,(H,26,30,31)
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n/an/a 0.340n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108164
PNG
(CHEMBL308264 | N-[2-(4'-Cyano-biphenyl-4-sulfonyl)...)
Show SMILES CC1(C)NC(=O)N(CC(CS(=O)(=O)c2ccc(cc2)-c2ccc(cc2)C#N)N(O)C=O)C1=O
Show InChI InChI=1S/C22H22N4O6S/c1-22(2)20(28)25(21(29)24-22)12-18(26(30)14-27)13-33(31,32)19-9-7-17(8-10-19)16-5-3-15(11-23)4-6-16/h3-10,14,18,30H,12-13H2,1-2H3,(H,24,29)
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n/an/a 0.340n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108131
PNG
(CHEMBL307413 | N-Hydroxy-N-{1-hydroxymethyl-2-[4-(...)
Show SMILES OCC(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C17H16F3NO7S/c18-17(19,20)28-15-3-1-13(2-4-15)27-14-5-7-16(8-6-14)29(25,26)10-12(9-22)21(24)11-23/h1-8,11-12,22,24H,9-10H2
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n/an/a 0.350n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108132
PNG
(CHEMBL75487 | N-[2-(3'-Cyanomethyl-biphenyl-4-sulf...)
Show SMILES CC1(C)NC(=O)N(CC(CS(=O)(=O)c2ccc(cc2)-c2cccc(CC#N)c2)N(O)C=O)C1=O
Show InChI InChI=1S/C23H24N4O6S/c1-23(2)21(29)26(22(30)25-23)13-19(27(31)15-28)14-34(32,33)20-8-6-17(7-9-20)18-5-3-4-16(12-18)10-11-24/h3-9,12,15,19,31H,10,13-14H2,1-2H3,(H,25,30)
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n/an/a 0.350n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108151
PNG
(CHEMBL75164 | N-{2,3-Dihydroxy-1-[4-(4-trifluorome...)
Show SMILES OC[C@@H](O)C(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C18H18F3NO8S/c19-18(20,21)30-14-3-1-12(2-4-14)29-13-5-7-15(8-6-13)31(27,28)10-16(17(25)9-23)22(26)11-24/h1-8,11,16-17,23,25-26H,9-10H2/t16?,17-/m1/s1
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n/an/a 0.360n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108137
PNG
(CHEMBL75529 | N-Hydroxy-N-{2-(morpholine-4-sulfony...)
Show SMILES ON(C=O)C(CS(=O)(=O)N1CCOCC1)CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C21H23F3N2O9S2/c22-21(23,24)35-19-3-1-17(2-4-19)34-18-5-7-20(8-6-18)36(29,30)13-16(26(28)15-27)14-37(31,32)25-9-11-33-12-10-25/h1-8,15-16,28H,9-14H2
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n/an/a 0.390n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50063917
PNG
((2S,3R)-N(4)-[(2S)-3,3-dimethyl-1-(methylamino)-1-...)
Show SMILES CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[C@H](O)C(=O)NO)C(C)(C)C
Show InChI InChI=1S/C15H29N3O5/c1-8(2)7-9(10(19)13(21)18-23)12(20)17-11(14(22)16-6)15(3,4)5/h8-11,19,23H,7H2,1-6H3,(H,16,22)(H,17,20)(H,18,21)/t9-,10+,11-/m1/s1
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n/an/a 0.410n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108153
PNG
(CHEMBL306276 | N-{1-(1,4-Dioxa-spiro[4.5]dec-8-yl)...)
Show SMILES ON(C=O)C(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)C1CCC2(CC1)OCCO2
Show InChI InChI=1S/C24H26F3NO8S/c25-24(26,27)36-20-3-1-18(2-4-20)35-19-5-7-21(8-6-19)37(31,32)15-22(28(30)16-29)17-9-11-23(12-10-17)33-13-14-34-23/h1-8,16-17,22,30H,9-15H2
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n/an/a 0.420n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108163
PNG
(CHEMBL309329 | N-Hydroxy-N-{1-(2-hydroxy-ethoxymet...)
Show SMILES OCCOCC(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C19H20F3NO8S/c20-19(21,22)31-17-3-1-15(2-4-17)30-16-5-7-18(8-6-16)32(27,28)12-14(23(26)13-25)11-29-10-9-24/h1-8,13-14,24,26H,9-12H2
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n/an/a 0.440n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108144
PNG
(CHEMBL75154 | N-[1-(4,4-Dimethyl-2,5-dioxo-imidazo...)
Show SMILES CC1(C)NC(=O)N(CC(CS(=O)(=O)c2ccc(cc2)-c2ccc(cc2)C(F)(F)F)N(O)C=O)C1=O
Show InChI InChI=1S/C22H22F3N3O6S/c1-21(2)19(30)27(20(31)26-21)11-17(28(32)13-29)12-35(33,34)18-9-5-15(6-10-18)14-3-7-16(8-4-14)22(23,24)25/h3-10,13,17,32H,11-12H2,1-2H3,(H,26,31)
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n/an/a 0.450n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix Metalloproteinase-8 (MMP-8)


(Homo sapiens (human))
BDBM50063917
PNG
((2S,3R)-N(4)-[(2S)-3,3-dimethyl-1-(methylamino)-1-...)
Show SMILES CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[C@H](O)C(=O)NO)C(C)(C)C
Show InChI InChI=1S/C15H29N3O5/c1-8(2)7-9(10(19)13(21)18-23)12(20)17-11(14(22)16-6)15(3,4)5/h8-11,19,23H,7H2,1-6H3,(H,16,22)(H,17,20)(H,18,21)/t9-,10+,11-/m1/s1
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n/an/a 0.470n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Matrix metalloprotease-8 (MMP-8) in fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50409487
PNG
(CHEMBL2115165)
Show SMILES CC1(C)OC[C@@H](O1)[C@@H](CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C21H22F3NO8S/c1-20(2)30-11-19(33-20)18(25(27)13-26)12-34(28,29)17-9-7-15(8-10-17)31-14-3-5-16(6-4-14)32-21(22,23)24/h3-10,13,18-19,27H,11-12H2,1-2H3/t18-,19-/m1/s1
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n/an/a 0.5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108143
PNG
(4-{3-(Formyl-hydroxy-amino)-4-[4-(4-trifluorometho...)
Show SMILES ON(C=O)C(CCc1ccc(cc1)C(O)=O)CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C25H22F3NO8S/c26-25(27,28)37-22-9-7-20(8-10-22)36-21-11-13-23(14-12-21)38(34,35)15-19(29(33)16-30)6-3-17-1-4-18(5-2-17)24(31)32/h1-2,4-5,7-14,16,19,33H,3,6,15H2,(H,31,32)
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n/an/a 0.530n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108143
PNG
(4-{3-(Formyl-hydroxy-amino)-4-[4-(4-trifluorometho...)
Show SMILES ON(C=O)C(CCc1ccc(cc1)C(O)=O)CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C25H22F3NO8S/c26-25(27,28)37-22-9-7-20(8-10-22)36-21-11-13-23(14-12-21)38(34,35)15-19(29(33)16-30)6-3-17-1-4-18(5-2-17)24(31)32/h1-2,4-5,7-14,16,19,33H,3,6,15H2,(H,31,32)
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n/an/a 0.530n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix Metalloproteinase-8 (MMP-8)


(Homo sapiens (human))
BDBM50082556
PNG
((S)-2,2-Dimethyl-4-[4-(pyridin-4-yloxy)-benzenesul...)
Show SMILES CC1(C)SCCN([C@H]1C(=O)NO)S(=O)(=O)c1ccc(Oc2ccncc2)cc1
Show InChI InChI=1S/C18H21N3O5S2/c1-18(2)16(17(22)20-23)21(11-12-27-18)28(24,25)15-5-3-13(4-6-15)26-14-7-9-19-10-8-14/h3-10,16,23H,11-12H2,1-2H3,(H,20,22)/t16-/m0/s1
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n/an/a 0.540n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Matrix metalloprotease-8 (MMP-8) in fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108149
PNG
(CHEMBL75189 | N-Hydroxy-N-{3-morpholin-4-yl-1-[4-(...)
Show SMILES ON(C=O)C(CCN1CCOCC1)CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C22H25F3N2O7S/c23-22(24,25)34-20-3-1-18(2-4-20)33-19-5-7-21(8-6-19)35(30,31)15-17(27(29)16-28)9-10-26-11-13-32-14-12-26/h1-8,16-17,29H,9-15H2
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n/an/a 0.570n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108147
PNG
(CHEMBL75114 | N-Hydroxy-N-{1-(tetrahydro-furan-2-y...)
Show SMILES ON(C=O)C(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)C1CCCO1
Show InChI InChI=1S/C20H20F3NO7S/c21-20(22,23)31-16-5-3-14(4-6-16)30-15-7-9-17(10-8-15)32(27,28)12-18(24(26)13-25)19-2-1-11-29-19/h3-10,13,18-19,26H,1-2,11-12H2
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n/an/a 0.610n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108141
PNG
(CHEMBL76757 | N-[1-(4,4-Dimethyl-2,5-dioxo-imidazo...)
Show SMILES CSc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)CC(CN1C(=O)NC(C)(C)C1=O)N(O)C=O
Show InChI InChI=1S/C22H25N3O6S2/c1-22(2)20(27)24(21(28)23-22)12-17(25(29)14-26)13-33(30,31)19-10-6-16(7-11-19)15-4-8-18(32-3)9-5-15/h4-11,14,17,29H,12-13H2,1-3H3,(H,23,28)
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n/an/a 0.670n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108157
PNG
(CHEMBL75139 | N-[2-[4-(4-Chloro-phenoxy)-benzenesu...)
Show SMILES CN1C(=O)N(CC(CS(=O)(=O)c2ccc(Oc3ccc(Cl)cc3)cc2)N(O)C=O)C(=O)C1(C)C
Show InChI InChI=1S/C22H24ClN3O7S/c1-22(2)20(28)25(21(29)24(22)3)12-16(26(30)14-27)13-34(31,32)19-10-8-18(9-11-19)33-17-6-4-15(23)5-7-17/h4-11,14,16,30H,12-13H2,1-3H3
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n/an/a 0.720n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50409487
PNG
(CHEMBL2115165)
Show SMILES CC1(C)OC[C@@H](O1)[C@@H](CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C21H22F3NO8S/c1-20(2)30-11-19(33-20)18(25(27)13-26)12-34(28,29)17-9-7-15(8-10-17)31-14-3-5-16(6-4-14)32-21(22,23)24/h3-10,13,18-19,27H,11-12H2,1-2H3/t18-,19-/m1/s1
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n/an/a 0.780n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50063917
PNG
((2S,3R)-N(4)-[(2S)-3,3-dimethyl-1-(methylamino)-1-...)
Show SMILES CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[C@H](O)C(=O)NO)C(C)(C)C
Show InChI InChI=1S/C15H29N3O5/c1-8(2)7-9(10(19)13(21)18-23)12(20)17-11(14(22)16-6)15(3,4)5/h8-11,19,23H,7H2,1-6H3,(H,16,22)(H,17,20)(H,18,21)/t9-,10+,11-/m1/s1
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n/an/a 0.780n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108138
PNG
(CHEMBL78052 | N-Hydroxy-N-{3-(4-methanesulfonyl-pi...)
Show SMILES CS(=O)(=O)N1CCN(CCC(CS(=O)(=O)c2ccc(Oc3ccc(OC(F)(F)F)cc3)cc2)N(O)C=O)CC1
Show InChI InChI=1S/C23H28F3N3O8S2/c1-38(32,33)28-14-12-27(13-15-28)11-10-18(29(31)17-30)16-39(34,35)22-8-6-20(7-9-22)36-19-2-4-21(5-3-19)37-23(24,25)26/h2-9,17-18,31H,10-16H2,1H3
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n/an/a 0.790n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50063917
PNG
((2S,3R)-N(4)-[(2S)-3,3-dimethyl-1-(methylamino)-1-...)
Show SMILES CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[C@H](O)C(=O)NO)C(C)(C)C
Show InChI InChI=1S/C15H29N3O5/c1-8(2)7-9(10(19)13(21)18-23)12(20)17-11(14(22)16-6)15(3,4)5/h8-11,19,23H,7H2,1-6H3,(H,16,22)(H,17,20)(H,18,21)/t9-,10+,11-/m1/s1
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n/an/a 0.790n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108166
PNG
(CHEMBL76043 | N-[1-(5,5-Dimethyl-2,4-dioxo-imidazo...)
Show SMILES CC1(C)N(CC(CS(=O)(=O)c2ccc(cc2)-c2ccc(OC(F)(F)F)cc2)N(O)C=O)C(=O)NC1=O
Show InChI InChI=1S/C22H22F3N3O7S/c1-21(2)19(30)26-20(31)27(21)11-16(28(32)13-29)12-36(33,34)18-9-5-15(6-10-18)14-3-7-17(8-4-14)35-22(23,24)25/h3-10,13,16,32H,11-12H2,1-2H3,(H,26,30,31)
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n/an/a 0.860n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108137
PNG
(CHEMBL75529 | N-Hydroxy-N-{2-(morpholine-4-sulfony...)
Show SMILES ON(C=O)C(CS(=O)(=O)N1CCOCC1)CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C21H23F3N2O9S2/c22-21(23,24)35-19-3-1-17(2-4-19)34-18-5-7-20(8-6-18)36(29,30)13-16(26(28)15-27)14-37(31,32)25-9-11-33-12-10-25/h1-8,15-16,28H,9-14H2
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n/an/a 0.860n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108150
PNG
(CHEMBL75567 | N-{1-Dimethylaminomethyl-2-[4-(4-tri...)
Show SMILES CN(C)CC(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C19H21F3N2O6S/c1-23(2)11-14(24(26)13-25)12-31(27,28)18-9-7-16(8-10-18)29-15-3-5-17(6-4-15)30-19(20,21)22/h3-10,13-14,26H,11-12H2,1-2H3
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n/an/a 0.900n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108156
PNG
(CHEMBL73866 | N-Hydroxy-N-{1-methoxymethyl-2-[4-(4...)
Show SMILES COCC(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C18H18F3NO7S/c1-27-10-13(22(24)12-23)11-30(25,26)17-8-6-15(7-9-17)28-14-2-4-16(5-3-14)29-18(19,20)21/h2-9,12-13,24H,10-11H2,1H3
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n/an/a 0.900n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108146
PNG
(CHEMBL307372 | N-Hydroxy-N-{1-(3-methyl-2,6-dioxo-...)
Show SMILES Cn1ccc(=O)n(CC(CS(=O)(=O)c2ccc(Oc3ccc(OC(F)(F)F)cc3)cc2)N(O)C=O)c1=O
Show InChI InChI=1S/C22H20F3N3O8S/c1-26-11-10-20(30)27(21(26)31)12-15(28(32)14-29)13-37(33,34)19-8-6-17(7-9-19)35-16-2-4-18(5-3-16)36-22(23,24)25/h2-11,14-15,32H,12-13H2,1H3
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n/an/a 0.910n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108132
PNG
(CHEMBL75487 | N-[2-(3'-Cyanomethyl-biphenyl-4-sulf...)
Show SMILES CC1(C)NC(=O)N(CC(CS(=O)(=O)c2ccc(cc2)-c2cccc(CC#N)c2)N(O)C=O)C1=O
Show InChI InChI=1S/C23H24N4O6S/c1-23(2)21(29)26(22(30)25-23)13-19(27(31)15-28)14-34(32,33)20-8-6-17(7-9-20)18-5-3-4-16(12-18)10-11-24/h3-9,12,15,19,31H,10,13-14H2,1-2H3,(H,25,30)
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n/an/a 0.910n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108158
PNG
(CHEMBL311618 | N-[2-[4-(4-Cyano-phenoxy)-benzenesu...)
Show SMILES CC1(C)NC(=O)N(CC(CS(=O)(=O)c2ccc(Oc3ccc(cc3)C#N)cc2)N(O)C=O)C1=O
Show InChI InChI=1S/C22H22N4O7S/c1-22(2)20(28)25(21(29)24-22)12-16(26(30)14-27)13-34(31,32)19-9-7-18(8-10-19)33-17-5-3-15(11-23)4-6-17/h3-10,14,16,30H,12-13H2,1-2H3,(H,24,29)
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n/an/a 0.930n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108159
PNG
(CHEMBL75302 | N-[2-[4-(4-Chloro-phenoxy)-benzenesu...)
Show SMILES CC1(C)NC(=O)N(CC(CS(=O)(=O)c2ccc(Oc3ccc(Cl)cc3)cc2)N(O)C=O)C1=O
Show InChI InChI=1S/C21H22ClN3O7S/c1-21(2)19(27)24(20(28)23-21)11-15(25(29)13-26)12-33(30,31)18-9-7-17(8-10-18)32-16-5-3-14(22)4-6-16/h3-10,13,15,29H,11-12H2,1-2H3,(H,23,28)
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n/an/a 0.960n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108136
PNG
(4-{3-(Formyl-hydroxy-amino)-4-[4-(4-trifluorometho...)
Show SMILES COC(=O)c1ccc(CCC(CS(=O)(=O)c2ccc(Oc3ccc(OC(F)(F)F)cc3)cc2)N(O)C=O)cc1
Show InChI InChI=1S/C26H24F3NO8S/c1-36-25(32)19-5-2-18(3-6-19)4-7-20(30(33)17-31)16-39(34,35)24-14-12-22(13-15-24)37-21-8-10-23(11-9-21)38-26(27,28)29/h2-3,5-6,8-15,17,20,33H,4,7,16H2,1H3
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n/an/a 0.980n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108165
PNG
(CHEMBL306050 | N-Hydroxy-N-[2-[4-(4-trifluorometho...)
Show SMILES C[C@@H]1OC(C)(C)OC1[C@@H](CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C22H24F3NO8S/c1-14-20(34-21(2,3)32-14)19(26(28)13-27)12-35(29,30)18-10-8-16(9-11-18)31-15-4-6-17(7-5-15)33-22(23,24)25/h4-11,13-14,19-20,28H,12H2,1-3H3/t14-,19+,20?/m0/s1
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108148
PNG
(CHEMBL75464 | N-{1-(2,2-Diethyl-[1,3]dioxolan-4-yl...)
Show SMILES CCC1(CC)OCC(O1)[C@@H](CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C23H26F3NO8S/c1-3-22(4-2)32-13-21(35-22)20(27(29)15-28)14-36(30,31)19-11-9-17(10-12-19)33-16-5-7-18(8-6-16)34-23(24,25)26/h5-12,15,20-21,29H,3-4,13-14H2,1-2H3/t20-,21?/m1/s1
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108141
PNG
(CHEMBL76757 | N-[1-(4,4-Dimethyl-2,5-dioxo-imidazo...)
Show SMILES CSc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)CC(CN1C(=O)NC(C)(C)C1=O)N(O)C=O
Show InChI InChI=1S/C22H25N3O6S2/c1-22(2)20(27)24(21(28)23-22)12-17(25(29)14-26)13-33(30,31)19-10-6-16(7-11-19)15-4-8-18(32-3)9-5-15/h4-11,14,17,29H,12-13H2,1-3H3,(H,23,28)
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (human))
BDBM50063917
PNG
((2S,3R)-N(4)-[(2S)-3,3-dimethyl-1-(methylamino)-1-...)
Show SMILES CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[C@H](O)C(=O)NO)C(C)(C)C
Show InChI InChI=1S/C15H29N3O5/c1-8(2)7-9(10(19)13(21)18-23)12(20)17-11(14(22)16-6)15(3,4)5/h8-11,19,23H,7H2,1-6H3,(H,16,22)(H,17,20)(H,18,21)/t9-,10+,11-/m1/s1
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n/an/a 1.20n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Matrix metalloprotease-13 (MMP-13) in fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108150
PNG
(CHEMBL75567 | N-{1-Dimethylaminomethyl-2-[4-(4-tri...)
Show SMILES CN(C)CC(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C19H21F3N2O6S/c1-23(2)11-14(24(26)13-25)12-31(27,28)18-9-7-16(8-10-18)29-15-3-5-17(6-4-15)30-19(20,21)22/h3-10,13-14,26H,11-12H2,1-2H3
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n/an/a 1.30n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108130
PNG
(CHEMBL309053 | N-{1-(4,4-Dimethyl-2,5-dioxo-imidaz...)
Show SMILES CC1(C)NC(=O)N(CC(CS(=O)(=O)c2ccc(Oc3ccc(OC(F)(F)F)cc3)cc2)N(O)C=O)C1=O
Show InChI InChI=1S/C22H22F3N3O8S/c1-21(2)19(30)27(20(31)26-21)11-14(28(32)13-29)12-37(33,34)18-9-7-16(8-10-18)35-15-3-5-17(6-4-15)36-22(23,24)25/h3-10,13-14,32H,11-12H2,1-2H3,(H,26,31)
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108157
PNG
(CHEMBL75139 | N-[2-[4-(4-Chloro-phenoxy)-benzenesu...)
Show SMILES CN1C(=O)N(CC(CS(=O)(=O)c2ccc(Oc3ccc(Cl)cc3)cc2)N(O)C=O)C(=O)C1(C)C
Show InChI InChI=1S/C22H24ClN3O7S/c1-22(2)20(28)25(21(29)24(22)3)12-16(26(30)14-27)13-34(31,32)19-10-8-18(9-11-19)33-17-6-4-15(23)5-7-17/h4-11,14,16,30H,12-13H2,1-3H3
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n/an/a 1.40n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108169
PNG
(CHEMBL73652 | N-[2-[4-(4-Cyano-phenoxy)-benzenesul...)
Show SMILES CN1C(=O)N(CC(CS(=O)(=O)c2ccc(Oc3ccc(cc3)C#N)cc2)N(O)C=O)C(=O)C1(C)C
Show InChI InChI=1S/C23H24N4O7S/c1-23(2)21(29)26(22(30)25(23)3)13-17(27(31)15-28)14-35(32,33)20-10-8-19(9-11-20)34-18-6-4-16(12-24)5-7-18/h4-11,15,17,31H,13-14H2,1-3H3
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108146
PNG
(CHEMBL307372 | N-Hydroxy-N-{1-(3-methyl-2,6-dioxo-...)
Show SMILES Cn1ccc(=O)n(CC(CS(=O)(=O)c2ccc(Oc3ccc(OC(F)(F)F)cc3)cc2)N(O)C=O)c1=O
Show InChI InChI=1S/C22H20F3N3O8S/c1-26-11-10-20(30)27(21(26)31)12-15(28(32)14-29)13-37(33,34)19-8-6-17(7-9-19)35-16-2-4-18(5-3-16)36-22(23,24)25/h2-11,14-15,32H,12-13H2,1H3
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108167
PNG
(CHEMBL306301 | N-{1-(2,2-Dimethyl-[1,3]dioxolan-4-...)
Show SMILES CC1(C)OCC(C[C@@H](CS(=O)(=O)c2ccc(Oc3ccc(OC(F)(F)F)cc3)cc2)N(O)C=O)O1
Show InChI InChI=1S/C22H24F3NO8S/c1-21(2)31-12-19(33-21)11-15(26(28)14-27)13-35(29,30)20-9-7-17(8-10-20)32-16-3-5-18(6-4-16)34-22(23,24)25/h3-10,14-15,19,28H,11-13H2,1-2H3/t15-,19?/m0/s1
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108155
PNG
(CHEMBL73928 | N-Hydroxy-N-{1-pyridin-2-yl-2-[4-(4-...)
Show SMILES ON(C=O)C(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)c1ccccn1
Show InChI InChI=1S/C21H17F3N2O6S/c22-21(23,24)32-17-6-4-15(5-7-17)31-16-8-10-18(11-9-16)33(29,30)13-20(26(28)14-27)19-3-1-2-12-25-19/h1-12,14,20,28H,13H2
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108149
PNG
(CHEMBL75189 | N-Hydroxy-N-{3-morpholin-4-yl-1-[4-(...)
Show SMILES ON(C=O)C(CCN1CCOCC1)CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C22H25F3N2O7S/c23-22(24,25)34-20-3-1-18(2-4-20)33-19-5-7-21(8-6-19)35(30,31)15-17(27(29)16-28)9-10-26-11-13-32-14-12-26/h1-8,16-17,29H,9-15H2
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108140
PNG
(CHEMBL275654 | N-{2-(Formyl-hydroxy-amino)-3-[4-(4...)
Show SMILES CN(CC(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O)S(C)(=O)=O
Show InChI InChI=1S/C19H21F3N2O8S2/c1-23(33(2,27)28)11-14(24(26)13-25)12-34(29,30)18-9-7-16(8-10-18)31-15-3-5-17(6-4-15)32-19(20,21)22/h3-10,13-14,26H,11-12H2,1-2H3
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n/an/a 1.70n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108169
PNG
(CHEMBL73652 | N-[2-[4-(4-Cyano-phenoxy)-benzenesul...)
Show SMILES CN1C(=O)N(CC(CS(=O)(=O)c2ccc(Oc3ccc(cc3)C#N)cc2)N(O)C=O)C(=O)C1(C)C
Show InChI InChI=1S/C23H24N4O7S/c1-23(2)21(29)26(22(30)25(23)3)13-17(27(31)15-28)14-35(32,33)20-10-8-19(9-11-20)34-18-6-4-16(12-24)5-7-18/h4-11,15,17,31H,13-14H2,1-3H3
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n/an/a 1.80n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108145
PNG
(CHEMBL77907 | N-Hydroxy-N-[2-[4-(4-trifluoromethox...)
Show SMILES CN1C(=O)N(CC(CS(=O)(=O)c2ccc(Oc3ccc(OC(F)(F)F)cc3)cc2)N(O)C=O)C(=O)C1(C)C
Show InChI InChI=1S/C23H24F3N3O8S/c1-22(2)20(31)28(21(32)27(22)3)12-15(29(33)14-30)13-38(34,35)19-10-8-17(9-11-19)36-16-4-6-18(7-5-16)37-23(24,25)26/h4-11,14-15,33H,12-13H2,1-3H3
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108161
PNG
(CHEMBL3037894 | N-Hydroxy-N-{1-(1-methanesulfonyl-...)
Show SMILES CS(=O)(=O)N1CCC[C@H]1[C@@H](CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C21H23F3N2O8S2/c1-35(29,30)26-12-2-3-19(26)20(25(28)14-27)13-36(31,32)18-10-8-16(9-11-18)33-15-4-6-17(7-5-15)34-21(22,23)24/h4-11,14,19-20,28H,2-3,12-13H2,1H3
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n/an/a 1.90n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108165
PNG
(CHEMBL306050 | N-Hydroxy-N-[2-[4-(4-trifluorometho...)
Show SMILES C[C@@H]1OC(C)(C)OC1[C@@H](CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C22H24F3NO8S/c1-14-20(34-21(2,3)32-14)19(26(28)13-27)12-35(29,30)18-10-8-16(9-11-18)31-15-4-6-17(7-5-15)33-22(23,24)25/h4-11,13-14,19-20,28H,12H2,1-3H3/t14-,19+,20?/m0/s1
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108134
PNG
(CHEMBL306585 | N-Hydroxy-N-{4-morpholin-4-yl-4-oxo...)
Show SMILES ON(C=O)C(CCC(=O)N1CCOCC1)CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C23H25F3N2O8S/c24-23(25,26)36-20-4-2-18(3-5-20)35-19-6-8-21(9-7-19)37(32,33)15-17(28(31)16-29)1-10-22(30)27-11-13-34-14-12-27/h2-9,16-17,31H,1,10-15H2
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108130
PNG
(CHEMBL309053 | N-{1-(4,4-Dimethyl-2,5-dioxo-imidaz...)
Show SMILES CC1(C)NC(=O)N(CC(CS(=O)(=O)c2ccc(Oc3ccc(OC(F)(F)F)cc3)cc2)N(O)C=O)C1=O
Show InChI InChI=1S/C22H22F3N3O8S/c1-21(2)19(30)27(20(31)26-21)11-14(28(32)13-29)12-37(33,34)18-9-7-16(8-10-18)35-15-3-5-17(6-4-15)36-22(23,24)25/h3-10,13-14,32H,11-12H2,1-2H3,(H,26,31)
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108161
PNG
(CHEMBL3037894 | N-Hydroxy-N-{1-(1-methanesulfonyl-...)
Show SMILES CS(=O)(=O)N1CCC[C@H]1[C@@H](CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C21H23F3N2O8S2/c1-35(29,30)26-12-2-3-19(26)20(25(28)14-27)13-36(31,32)18-10-8-16(9-11-18)33-15-4-6-17(7-5-15)34-21(22,23)24/h4-11,14,19-20,28H,2-3,12-13H2,1H3
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108153
PNG
(CHEMBL306276 | N-{1-(1,4-Dioxa-spiro[4.5]dec-8-yl)...)
Show SMILES ON(C=O)C(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)C1CCC2(CC1)OCCO2
Show InChI InChI=1S/C24H26F3NO8S/c25-24(26,27)36-20-3-1-18(2-4-20)35-19-5-7-21(8-6-19)37(31,32)15-22(28(30)16-29)17-9-11-23(12-10-17)33-13-14-34-23/h1-8,16-17,22,30H,9-15H2
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108155
PNG
(CHEMBL73928 | N-Hydroxy-N-{1-pyridin-2-yl-2-[4-(4-...)
Show SMILES ON(C=O)C(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)c1ccccn1
Show InChI InChI=1S/C21H17F3N2O6S/c22-21(23,24)32-17-6-4-15(5-7-17)31-16-8-10-18(11-9-16)33(29,30)13-20(26(28)14-27)19-3-1-2-12-25-19/h1-12,14,20,28H,13H2
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n/an/a 2.20n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108156
PNG
(CHEMBL73866 | N-Hydroxy-N-{1-methoxymethyl-2-[4-(4...)
Show SMILES COCC(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C18H18F3NO7S/c1-27-10-13(22(24)12-23)11-30(25,26)17-8-6-15(7-9-17)28-14-2-4-16(5-3-14)29-18(19,20)21/h2-9,12-13,24H,10-11H2,1H3
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n/an/a 2.40n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108154
PNG
(CHEMBL75618 | N-[2-(4'-Butoxy-biphenyl-4-sulfonyl)...)
Show SMILES CCCCOc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)CC(CN1C(=O)NC(C)(C)C1=O)N(O)C=O
Show InChI InChI=1S/C25H31N3O7S/c1-4-5-14-35-21-10-6-18(7-11-21)19-8-12-22(13-9-19)36(33,34)16-20(28(32)17-29)15-27-23(30)25(2,3)26-24(27)31/h6-13,17,20,32H,4-5,14-16H2,1-3H3,(H,26,31)
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n/an/a 2.40n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108134
PNG
(CHEMBL306585 | N-Hydroxy-N-{4-morpholin-4-yl-4-oxo...)
Show SMILES ON(C=O)C(CCC(=O)N1CCOCC1)CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C23H25F3N2O8S/c24-23(25,26)36-20-4-2-18(3-5-20)35-19-6-8-21(9-7-19)37(32,33)15-17(28(31)16-29)1-10-22(30)27-11-13-34-14-12-27/h2-9,16-17,31H,1,10-15H2
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n/an/a 2.60n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108171
PNG
(CHEMBL77874 | N-Hydroxy-N-{3-hydroxy-2-hydroxymeth...)
Show SMILES OCC(CO)C(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C19H20F3NO8S/c20-19(21,22)31-16-3-1-14(2-4-16)30-15-5-7-17(8-6-15)32(28,29)11-18(23(27)12-26)13(9-24)10-25/h1-8,12-13,18,24-25,27H,9-11H2
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108141
PNG
(CHEMBL76757 | N-[1-(4,4-Dimethyl-2,5-dioxo-imidazo...)
Show SMILES CSc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)CC(CN1C(=O)NC(C)(C)C1=O)N(O)C=O
Show InChI InChI=1S/C22H25N3O6S2/c1-22(2)20(27)24(21(28)23-22)12-17(25(29)14-26)13-33(30,31)19-10-6-16(7-11-19)15-4-8-18(32-3)9-5-15/h4-11,14,17,29H,12-13H2,1-3H3,(H,23,28)
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (human))
BDBM50409487
PNG
(CHEMBL2115165)
Show SMILES CC1(C)OC[C@@H](O1)[C@@H](CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C21H22F3NO8S/c1-20(2)30-11-19(33-20)18(25(27)13-26)12-34(28,29)17-9-7-15(8-10-17)31-14-3-5-16(6-4-14)32-21(22,23)24/h3-10,13,18-19,27H,11-12H2,1-2H3/t18-,19-/m1/s1
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n/an/a 3.30n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Matrix metalloprotease-13 (MMP-13) in fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (human))
BDBM50082556
PNG
((S)-2,2-Dimethyl-4-[4-(pyridin-4-yloxy)-benzenesul...)
Show SMILES CC1(C)SCCN([C@H]1C(=O)NO)S(=O)(=O)c1ccc(Oc2ccncc2)cc1
Show InChI InChI=1S/C18H21N3O5S2/c1-18(2)16(17(22)20-23)21(11-12-27-18)28(24,25)15-5-3-13(4-6-15)26-14-7-9-19-10-8-14/h3-10,16,23H,11-12H2,1-2H3,(H,20,22)/t16-/m0/s1
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n/an/a 3.5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Matrix metalloprotease-3 (MMP-3) in fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108164
PNG
(CHEMBL308264 | N-[2-(4'-Cyano-biphenyl-4-sulfonyl)...)
Show SMILES CC1(C)NC(=O)N(CC(CS(=O)(=O)c2ccc(cc2)-c2ccc(cc2)C#N)N(O)C=O)C1=O
Show InChI InChI=1S/C22H22N4O6S/c1-22(2)20(28)25(21(29)24-22)12-18(26(30)14-27)13-33(31,32)19-9-7-17(8-10-19)16-5-3-15(11-23)4-6-16/h3-10,14,18,30H,12-13H2,1-2H3,(H,24,29)
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n/an/a 3.60n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108160
PNG
(CHEMBL74151 | N-Hydroxy-N-{1-(thiophen-2-ylsulfany...)
Show SMILES ON(C=O)C(CSc1cccs1)CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C21H18F3NO6S3/c22-21(23,24)31-18-5-3-16(4-6-18)30-17-7-9-19(10-8-17)34(28,29)13-15(25(27)14-26)12-33-20-2-1-11-32-20/h1-11,14-15,27H,12-13H2
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n/an/a 3.60n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108152
PNG
(CHEMBL75437 | N-[2-(5,5-Dimethyl-2,4-dioxo-imidazo...)
Show SMILES CC1(C)N(CC(COc2ccc(cc2)-c2ccc(OC(F)(F)F)cc2)N(O)C=O)C(=O)NC1=O
Show InChI InChI=1S/C22H22F3N3O6/c1-21(2)19(30)26-20(31)27(21)11-16(28(32)13-29)12-33-17-7-3-14(4-8-17)15-5-9-18(10-6-15)34-22(23,24)25/h3-10,13,16,32H,11-12H2,1-2H3,(H,26,30,31)
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n/an/a 3.70n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108158
PNG
(CHEMBL311618 | N-[2-[4-(4-Cyano-phenoxy)-benzenesu...)
Show SMILES CC1(C)NC(=O)N(CC(CS(=O)(=O)c2ccc(Oc3ccc(cc3)C#N)cc2)N(O)C=O)C1=O
Show InChI InChI=1S/C22H22N4O7S/c1-22(2)20(28)25(21(29)24-22)12-16(26(30)14-27)13-34(31,32)19-9-7-18(8-10-19)33-17-5-3-15(11-23)4-6-17/h3-10,14,16,30H,12-13H2,1-2H3,(H,24,29)
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n/an/a 3.90n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108170
PNG
(CHEMBL307915 | N-Hydroxy-N-{1-phenyl-2-[4-(4-trifl...)
Show SMILES ON(C=O)C(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)c1ccccc1
Show InChI InChI=1S/C22H18F3NO6S/c23-22(24,25)32-19-8-6-17(7-9-19)31-18-10-12-20(13-11-18)33(29,30)14-21(26(28)15-27)16-4-2-1-3-5-16/h1-13,15,21,28H,14H2
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n/an/a 4.10n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-7 (MMP7)


(Homo sapiens (Human))
BDBM50063917
PNG
((2S,3R)-N(4)-[(2S)-3,3-dimethyl-1-(methylamino)-1-...)
Show SMILES CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[C@H](O)C(=O)NO)C(C)(C)C
Show InChI InChI=1S/C15H29N3O5/c1-8(2)7-9(10(19)13(21)18-23)12(20)17-11(14(22)16-6)15(3,4)5/h8-11,19,23H,7H2,1-6H3,(H,16,22)(H,17,20)(H,18,21)/t9-,10+,11-/m1/s1
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n/an/a 4.10n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Matrix metalloprotease-7 (MMP-7) in fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108164
PNG
(CHEMBL308264 | N-[2-(4'-Cyano-biphenyl-4-sulfonyl)...)
Show SMILES CC1(C)NC(=O)N(CC(CS(=O)(=O)c2ccc(cc2)-c2ccc(cc2)C#N)N(O)C=O)C1=O
Show InChI InChI=1S/C22H22N4O6S/c1-22(2)20(28)25(21(29)24-22)12-18(26(30)14-27)13-33(31,32)19-9-7-17(8-10-19)16-5-3-15(11-23)4-6-16/h3-10,14,18,30H,12-13H2,1-2H3,(H,24,29)
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n/an/a 4.10n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108171
PNG
(CHEMBL77874 | N-Hydroxy-N-{3-hydroxy-2-hydroxymeth...)
Show SMILES OCC(CO)C(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C19H20F3NO8S/c20-19(21,22)31-16-3-1-14(2-4-16)30-15-5-7-17(8-6-15)32(28,29)11-18(23(27)12-26)13(9-24)10-25/h1-8,12-13,18,24-25,27H,9-11H2
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n/an/a 4.90n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix Metalloproteinase-8 (MMP-8)


(Homo sapiens (human))
BDBM50409487
PNG
(CHEMBL2115165)
Show SMILES CC1(C)OC[C@@H](O1)[C@@H](CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C21H22F3NO8S/c1-20(2)30-11-19(33-20)18(25(27)13-26)12-34(28,29)17-9-7-15(8-10-17)31-14-3-5-16(6-4-14)32-21(22,23)24/h3-10,13,18-19,27H,11-12H2,1-2H3/t18-,19-/m1/s1
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n/an/a 5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Matrix metalloprotease-8 (MMP-8) in fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108167
PNG
(CHEMBL306301 | N-{1-(2,2-Dimethyl-[1,3]dioxolan-4-...)
Show SMILES CC1(C)OCC(C[C@@H](CS(=O)(=O)c2ccc(Oc3ccc(OC(F)(F)F)cc3)cc2)N(O)C=O)O1
Show InChI InChI=1S/C22H24F3NO8S/c1-21(2)31-12-19(33-21)11-15(26(28)14-27)13-35(29,30)20-9-7-17(8-10-20)32-16-3-5-18(6-4-16)34-22(23,24)25/h3-10,14-15,19,28H,11-13H2,1-2H3/t15-,19?/m0/s1
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n/an/a 5.5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50082556
PNG
((S)-2,2-Dimethyl-4-[4-(pyridin-4-yloxy)-benzenesul...)
Show SMILES CC1(C)SCCN([C@H]1C(=O)NO)S(=O)(=O)c1ccc(Oc2ccncc2)cc1
Show InChI InChI=1S/C18H21N3O5S2/c1-18(2)16(17(22)20-23)21(11-12-27-18)28(24,25)15-5-3-13(4-6-15)26-14-7-9-19-10-8-14/h3-10,16,23H,11-12H2,1-2H3,(H,20,22)/t16-/m0/s1
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n/an/a 5.70n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108154
PNG
(CHEMBL75618 | N-[2-(4'-Butoxy-biphenyl-4-sulfonyl)...)
Show SMILES CCCCOc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)CC(CN1C(=O)NC(C)(C)C1=O)N(O)C=O
Show InChI InChI=1S/C25H31N3O7S/c1-4-5-14-35-21-10-6-18(7-11-21)19-8-12-22(13-9-19)36(33,34)16-20(28(32)17-29)15-27-23(30)25(2,3)26-24(27)31/h6-13,17,20,32H,4-5,14-16H2,1-3H3,(H,26,31)
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n/an/a 6.20n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108135
PNG
(2-(Formyl-hydroxy-amino)-3-[4-(4-trifluoromethoxy-...)
Show SMILES CN(C)S(=O)(=O)CC(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C19H21F3N2O8S2/c1-23(2)34(29,30)12-14(24(26)13-25)11-33(27,28)18-9-7-16(8-10-18)31-15-3-5-17(6-4-15)32-19(20,21)22/h3-10,13-14,26H,11-12H2,1-2H3
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n/an/a 7.20n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108170
PNG
(CHEMBL307915 | N-Hydroxy-N-{1-phenyl-2-[4-(4-trifl...)
Show SMILES ON(C=O)C(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)c1ccccc1
Show InChI InChI=1S/C22H18F3NO6S/c23-22(24,25)32-19-8-6-17(7-9-19)31-18-10-12-20(13-11-18)33(29,30)14-21(26(28)15-27)16-4-2-1-3-5-16/h1-13,15,21,28H,14H2
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n/an/a 7.40n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108133
PNG
(CHEMBL74812 | N-Hydroxy-N-{1-(1-methyl-1H-indol-2-...)
Show SMILES Cn1c(cc2ccccc12)C(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C25H21F3N2O6S/c1-29-22-5-3-2-4-17(22)14-23(29)24(30(32)16-31)15-37(33,34)21-12-10-19(11-13-21)35-18-6-8-20(9-7-18)36-25(26,27)28/h2-14,16,24,32H,15H2,1H3
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n/an/a 9.5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108160
PNG
(CHEMBL74151 | N-Hydroxy-N-{1-(thiophen-2-ylsulfany...)
Show SMILES ON(C=O)C(CSc1cccs1)CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C21H18F3NO6S3/c22-21(23,24)31-18-5-3-16(4-6-18)30-17-7-9-19(10-8-17)34(28,29)13-15(25(27)14-26)12-33-20-2-1-11-32-20/h1-11,14-15,27H,12-13H2
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n/an/a 9.70n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108144
PNG
(CHEMBL75154 | N-[1-(4,4-Dimethyl-2,5-dioxo-imidazo...)
Show SMILES CC1(C)NC(=O)N(CC(CS(=O)(=O)c2ccc(cc2)-c2ccc(cc2)C(F)(F)F)N(O)C=O)C1=O
Show InChI InChI=1S/C22H22F3N3O6S/c1-21(2)19(30)27(20(31)26-21)11-17(28(32)13-29)12-35(33,34)18-9-5-15(6-10-18)14-3-7-16(8-4-14)22(23,24)25/h3-10,13,17,32H,11-12H2,1-2H3,(H,26,31)
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n/an/a 10n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50084661
PNG
(4-(4'-Chloro-biphenyl-4-yl)-4-oxo-2-phenylsulfanyl...)
Show SMILES OC(=O)[C@@H](CSc1ccccc1)CC(=O)c1ccc(cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C23H19ClO3S/c24-20-12-10-17(11-13-20)16-6-8-18(9-7-16)22(25)14-19(23(26)27)15-28-21-4-2-1-3-5-21/h1-13,19H,14-15H2,(H,26,27)/t19-/m1/s1
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n/an/a 11n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (human))
BDBM50409487
PNG
(CHEMBL2115165)
Show SMILES CC1(C)OC[C@@H](O1)[C@@H](CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C21H22F3NO8S/c1-20(2)30-11-19(33-20)18(25(27)13-26)12-34(28,29)17-9-7-15(8-10-17)31-14-3-5-16(6-4-14)32-21(22,23)24/h3-10,13,18-19,27H,11-12H2,1-2H3/t18-,19-/m1/s1
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n/an/a 12n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Matrix metalloprotease-3 (MMP-3) in fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108140
PNG
(CHEMBL275654 | N-{2-(Formyl-hydroxy-amino)-3-[4-(4...)
Show SMILES CN(CC(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O)S(C)(=O)=O
Show InChI InChI=1S/C19H21F3N2O8S2/c1-23(33(2,27)28)11-14(24(26)13-25)12-34(29,30)18-9-7-16(8-10-18)31-15-3-5-17(6-4-15)32-19(20,21)22/h3-10,13-14,26H,11-12H2,1-2H3
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n/an/a 12n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108133
PNG
(CHEMBL74812 | N-Hydroxy-N-{1-(1-methyl-1H-indol-2-...)
Show SMILES Cn1c(cc2ccccc12)C(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C25H21F3N2O6S/c1-29-22-5-3-2-4-17(22)14-23(29)24(30(32)16-31)15-37(33,34)21-12-10-19(11-13-21)35-18-6-8-20(9-7-18)36-25(26,27)28/h2-14,16,24,32H,15H2,1H3
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n/an/a 12n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (human))
BDBM50063917
PNG
((2S,3R)-N(4)-[(2S)-3,3-dimethyl-1-(methylamino)-1-...)
Show SMILES CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[C@H](O)C(=O)NO)C(C)(C)C
Show InChI InChI=1S/C15H29N3O5/c1-8(2)7-9(10(19)13(21)18-23)12(20)17-11(14(22)16-6)15(3,4)5/h8-11,19,23H,7H2,1-6H3,(H,16,22)(H,17,20)(H,18,21)/t9-,10+,11-/m1/s1
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n/an/a 14n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Matrix metalloprotease-3 (MMP-3) in fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108148
PNG
(CHEMBL75464 | N-{1-(2,2-Diethyl-[1,3]dioxolan-4-yl...)
Show SMILES CCC1(CC)OCC(O1)[C@@H](CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C23H26F3NO8S/c1-3-22(4-2)32-13-21(35-22)20(27(29)15-28)14-36(30,31)19-11-9-17(10-12-19)33-16-5-7-18(8-6-16)34-23(24,25)26/h5-12,15,20-21,29H,3-4,13-14H2,1-2H3/t20-,21?/m1/s1
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n/an/a 20n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108168
PNG
(2-[2-Mercapto-4-(3,4,4-trimethyl-2,5-dioxo-imidazo...)
Show SMILES CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](S)CCN1C(=O)N(C)C(C)(C)C1=O)C(C)(C)C
Show InChI InChI=1S/C23H41N5O5S/c1-13(2)12-14(17(29)26-16(19(31)24-8)22(3,4)5)25-18(30)15(34)10-11-28-20(32)23(6,7)27(9)21(28)33/h13-16,34H,10-12H2,1-9H3,(H,24,31)(H,25,30)(H,26,29)/t14-,15-,16+/m0/s1
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n/an/a 25n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108168
PNG
(2-[2-Mercapto-4-(3,4,4-trimethyl-2,5-dioxo-imidazo...)
Show SMILES CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](S)CCN1C(=O)N(C)C(C)(C)C1=O)C(C)(C)C
Show InChI InChI=1S/C23H41N5O5S/c1-13(2)12-14(17(29)26-16(19(31)24-8)22(3,4)5)25-18(30)15(34)10-11-28-20(32)23(6,7)27(9)21(28)33/h13-16,34H,10-12H2,1-9H3,(H,24,31)(H,25,30)(H,26,29)/t14-,15-,16+/m0/s1
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n/an/a 25n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108136
PNG
(4-{3-(Formyl-hydroxy-amino)-4-[4-(4-trifluorometho...)
Show SMILES COC(=O)c1ccc(CCC(CS(=O)(=O)c2ccc(Oc3ccc(OC(F)(F)F)cc3)cc2)N(O)C=O)cc1
Show InChI InChI=1S/C26H24F3NO8S/c1-36-25(32)19-5-2-18(3-6-19)4-7-20(30(33)17-31)16-39(34,35)24-14-12-22(13-15-24)37-21-8-10-23(11-9-21)38-26(27,28)29/h2-3,5-6,8-15,17,20,33H,4,7,16H2,1H3
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n/an/a 34n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108139
PNG
(CHEMBL74365 | N-Hydroxy-N-[2-[4-(4-trifluoromethox...)
Show SMILES ON(C=O)C(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C23H17F6NO6S/c24-22(25,26)16-3-1-15(2-4-16)21(30(32)14-31)13-37(33,34)20-11-9-18(10-12-20)35-17-5-7-19(8-6-17)36-23(27,28)29/h1-12,14,21,32H,13H2
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n/an/a 37n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108168
PNG
(2-[2-Mercapto-4-(3,4,4-trimethyl-2,5-dioxo-imidazo...)
Show SMILES CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](S)CCN1C(=O)N(C)C(C)(C)C1=O)C(C)(C)C
Show InChI InChI=1S/C23H41N5O5S/c1-13(2)12-14(17(29)26-16(19(31)24-8)22(3,4)5)25-18(30)15(34)10-11-28-20(32)23(6,7)27(9)21(28)33/h13-16,34H,10-12H2,1-9H3,(H,24,31)(H,25,30)(H,26,29)/t14-,15-,16+/m0/s1
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n/an/a 41n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108144
PNG
(CHEMBL75154 | N-[1-(4,4-Dimethyl-2,5-dioxo-imidazo...)
Show SMILES CC1(C)NC(=O)N(CC(CS(=O)(=O)c2ccc(cc2)-c2ccc(cc2)C(F)(F)F)N(O)C=O)C1=O
Show InChI InChI=1S/C22H22F3N3O6S/c1-21(2)19(30)27(20(31)26-21)11-17(28(32)13-29)12-35(33,34)18-9-5-15(6-10-18)14-3-7-16(8-4-14)22(23,24)25/h3-10,13,17,32H,11-12H2,1-2H3,(H,26,31)
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n/an/a 44n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50108139
PNG
(CHEMBL74365 | N-Hydroxy-N-[2-[4-(4-trifluoromethox...)
Show SMILES ON(C=O)C(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C23H17F6NO6S/c24-22(25,26)16-3-1-15(2-4-16)21(30(32)14-31)13-37(33,34)20-11-9-18(10-12-20)35-17-5-7-19(8-6-17)36-23(27,28)29/h1-12,14,21,32H,13H2
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n/an/a 62n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-7 (MMP7)


(Homo sapiens (Human))
BDBM50082556
PNG
((S)-2,2-Dimethyl-4-[4-(pyridin-4-yloxy)-benzenesul...)
Show SMILES CC1(C)SCCN([C@H]1C(=O)NO)S(=O)(=O)c1ccc(Oc2ccncc2)cc1
Show InChI InChI=1S/C18H21N3O5S2/c1-18(2)16(17(22)20-23)21(11-12-27-18)28(24,25)15-5-3-13(4-6-15)26-14-7-9-19-10-8-14/h3-10,16,23H,11-12H2,1-2H3,(H,20,22)/t16-/m0/s1
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n/an/a 72n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Matrix metalloprotease-7 (MMP-7) in fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108132
PNG
(CHEMBL75487 | N-[2-(3'-Cyanomethyl-biphenyl-4-sulf...)
Show SMILES CC1(C)NC(=O)N(CC(CS(=O)(=O)c2ccc(cc2)-c2cccc(CC#N)c2)N(O)C=O)C1=O
Show InChI InChI=1S/C23H24N4O6S/c1-23(2)21(29)26(22(30)25-23)13-19(27(31)15-28)14-34(32,33)20-8-6-17(7-9-20)18-5-3-4-16(12-18)10-11-24/h3-9,12,15,19,31H,10,13-14H2,1-2H3,(H,25,30)
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n/an/a 78n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108166
PNG
(CHEMBL76043 | N-[1-(5,5-Dimethyl-2,4-dioxo-imidazo...)
Show SMILES CC1(C)N(CC(CS(=O)(=O)c2ccc(cc2)-c2ccc(OC(F)(F)F)cc2)N(O)C=O)C(=O)NC1=O
Show InChI InChI=1S/C22H22F3N3O7S/c1-21(2)19(30)26-20(31)27(21)11-16(28(32)13-29)12-36(33,34)18-9-5-15(6-10-18)14-3-7-17(8-4-14)35-22(23,24)25/h3-10,13,16,32H,11-12H2,1-2H3,(H,26,30,31)
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n/an/a 82n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108159
PNG
(CHEMBL75302 | N-[2-[4-(4-Chloro-phenoxy)-benzenesu...)
Show SMILES CC1(C)NC(=O)N(CC(CS(=O)(=O)c2ccc(Oc3ccc(Cl)cc3)cc2)N(O)C=O)C1=O
Show InChI InChI=1S/C21H22ClN3O7S/c1-21(2)19(27)24(20(28)23-21)11-15(25(29)13-26)12-33(30,31)18-9-7-17(8-10-18)32-16-5-3-14(22)4-6-16/h3-10,13,15,29H,11-12H2,1-2H3,(H,23,28)
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n/an/a 90n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50108152
PNG
(CHEMBL75437 | N-[2-(5,5-Dimethyl-2,4-dioxo-imidazo...)
Show SMILES CC1(C)N(CC(COc2ccc(cc2)-c2ccc(OC(F)(F)F)cc2)N(O)C=O)C(=O)NC1=O
Show InChI InChI=1S/C22H22F3N3O6/c1-21(2)19(30)26-20(31)27(21)11-16(28(32)13-29)12-33-17-7-3-14(4-8-17)15-5-9-18(10-6-15)34-22(23,24)25/h3-10,13,16,32H,11-12H2,1-2H3,(H,26,30,31)
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n/an/a 120n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (human))
BDBM50084661
PNG
(4-(4'-Chloro-biphenyl-4-yl)-4-oxo-2-phenylsulfanyl...)
Show SMILES OC(=O)[C@@H](CSc1ccccc1)CC(=O)c1ccc(cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C23H19ClO3S/c24-20-12-10-17(11-13-20)16-6-8-18(9-7-16)22(25)14-19(23(26)27)15-28-21-4-2-1-3-5-21/h1-13,19H,14-15H2,(H,26,27)/t19-/m1/s1
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n/an/a 134n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Matrix metalloprotease-3 (MMP-3) in fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (human))
BDBM50108168
PNG
(2-[2-Mercapto-4-(3,4,4-trimethyl-2,5-dioxo-imidazo...)
Show SMILES CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](S)CCN1C(=O)N(C)C(C)(C)C1=O)C(C)(C)C
Show InChI InChI=1S/C23H41N5O5S/c1-13(2)12-14(17(29)26-16(19(31)24-8)22(3,4)5)25-18(30)15(34)10-11-28-20(32)23(6,7)27(9)21(28)33/h13-16,34H,10-12H2,1-9H3,(H,24,31)(H,25,30)(H,26,29)/t14-,15-,16+/m0/s1
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n/an/a 157n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Matrix metalloprotease-3 (MMP-3) in fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108154
PNG
(CHEMBL75618 | N-[2-(4'-Butoxy-biphenyl-4-sulfonyl)...)
Show SMILES CCCCOc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)CC(CN1C(=O)NC(C)(C)C1=O)N(O)C=O
Show InChI InChI=1S/C25H31N3O7S/c1-4-5-14-35-21-10-6-18(7-11-21)19-8-12-22(13-9-19)36(33,34)16-20(28(32)17-29)15-27-23(30)25(2,3)26-24(27)31/h6-13,17,20,32H,4-5,14-16H2,1-3H3,(H,26,31)
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n/an/a 240n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50024168
PNG
(CHEMBL2114138)
Show SMILES CC1(C)OC[C@H](O1)[C@@H](CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C21H22F3NO8S/c1-20(2)30-11-19(33-20)18(25(27)13-26)12-34(28,29)17-9-7-15(8-10-17)31-14-3-5-16(6-4-14)32-21(22,23)24/h3-10,13,18-19,27H,11-12H2,1-2H3/t18-,19+/m1/s1
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n/an/a 260n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-2 (MMP-2) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108157
PNG
(CHEMBL75139 | N-[2-[4-(4-Chloro-phenoxy)-benzenesu...)
Show SMILES CN1C(=O)N(CC(CS(=O)(=O)c2ccc(Oc3ccc(Cl)cc3)cc2)N(O)C=O)C(=O)C1(C)C
Show InChI InChI=1S/C22H24ClN3O7S/c1-22(2)20(28)25(21(29)24(22)3)12-16(26(30)14-27)13-34(31,32)19-10-8-18(9-11-19)33-17-6-4-15(23)5-7-17/h4-11,14,16,30H,12-13H2,1-3H3
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n/an/a 280n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50084661
PNG
(4-(4'-Chloro-biphenyl-4-yl)-4-oxo-2-phenylsulfanyl...)
Show SMILES OC(=O)[C@@H](CSc1ccccc1)CC(=O)c1ccc(cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C23H19ClO3S/c24-20-12-10-17(11-13-20)16-6-8-18(9-7-16)22(25)14-19(23(26)27)15-28-21-4-2-1-3-5-21/h1-13,19H,14-15H2,(H,26,27)/t19-/m1/s1
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n/an/a 301n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50024168
PNG
(CHEMBL2114138)
Show SMILES CC1(C)OC[C@H](O1)[C@@H](CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C21H22F3NO8S/c1-20(2)30-11-19(33-20)18(25(27)13-26)12-34(28,29)17-9-7-15(8-10-17)31-14-3-5-16(6-4-14)32-21(22,23)24/h3-10,13,18-19,27H,11-12H2,1-2H3/t18-,19+/m1/s1
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n/an/a 480n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against Matrix metalloprotease-9 (MMP-9) using fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108130
PNG
(CHEMBL309053 | N-{1-(4,4-Dimethyl-2,5-dioxo-imidaz...)
Show SMILES CC1(C)NC(=O)N(CC(CS(=O)(=O)c2ccc(Oc3ccc(OC(F)(F)F)cc3)cc2)N(O)C=O)C1=O
Show InChI InChI=1S/C22H22F3N3O8S/c1-21(2)19(30)27(20(31)26-21)11-14(28(32)13-29)12-37(33,34)18-9-7-16(8-10-18)35-15-3-5-17(6-4-15)36-22(23,24)25/h3-10,13-14,32H,11-12H2,1-2H3,(H,26,31)
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n/an/a 820n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108158
PNG
(CHEMBL311618 | N-[2-[4-(4-Cyano-phenoxy)-benzenesu...)
Show SMILES CC1(C)NC(=O)N(CC(CS(=O)(=O)c2ccc(Oc3ccc(cc3)C#N)cc2)N(O)C=O)C1=O
Show InChI InChI=1S/C22H22N4O7S/c1-22(2)20(28)25(21(29)24-22)12-16(26(30)14-27)13-34(31,32)19-9-7-18(8-10-19)33-17-5-3-15(11-23)4-6-17/h3-10,14,16,30H,12-13H2,1-2H3,(H,24,29)
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n/an/a 990n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108140
PNG
(CHEMBL275654 | N-{2-(Formyl-hydroxy-amino)-3-[4-(4...)
Show SMILES CN(CC(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O)S(C)(=O)=O
Show InChI InChI=1S/C19H21F3N2O8S2/c1-23(33(2,27)28)11-14(24(26)13-25)12-34(29,30)18-9-7-16(8-10-18)31-15-3-5-17(6-4-15)32-19(20,21)22/h3-10,13-14,26H,11-12H2,1-2H3
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n/an/a 2.00E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108137
PNG
(CHEMBL75529 | N-Hydroxy-N-{2-(morpholine-4-sulfony...)
Show SMILES ON(C=O)C(CS(=O)(=O)N1CCOCC1)CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C21H23F3N2O9S2/c22-21(23,24)35-19-3-1-17(2-4-19)34-18-5-7-20(8-6-18)36(29,30)13-16(26(28)15-27)14-37(31,32)25-9-11-33-12-10-25/h1-8,15-16,28H,9-14H2
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n/an/a 2.50E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108169
PNG
(CHEMBL73652 | N-[2-[4-(4-Cyano-phenoxy)-benzenesul...)
Show SMILES CN1C(=O)N(CC(CS(=O)(=O)c2ccc(Oc3ccc(cc3)C#N)cc2)N(O)C=O)C(=O)C1(C)C
Show InChI InChI=1S/C23H24N4O7S/c1-23(2)21(29)26(22(30)25(23)3)13-17(27(31)15-28)14-35(32,33)20-10-8-19(9-11-20)34-18-6-4-16(12-24)5-7-18/h4-11,15,17,31H,13-14H2,1-3H3
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n/an/a 2.50E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108131
PNG
(CHEMBL307413 | N-Hydroxy-N-{1-hydroxymethyl-2-[4-(...)
Show SMILES OCC(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C17H16F3NO7S/c18-17(19,20)28-15-3-1-13(2-4-15)27-14-5-7-16(8-6-14)29(25,26)10-12(9-22)21(24)11-23/h1-8,11-12,22,24H,9-10H2
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n/an/a 4.50E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108152
PNG
(CHEMBL75437 | N-[2-(5,5-Dimethyl-2,4-dioxo-imidazo...)
Show SMILES CC1(C)N(CC(COc2ccc(cc2)-c2ccc(OC(F)(F)F)cc2)N(O)C=O)C(=O)NC1=O
Show InChI InChI=1S/C22H22F3N3O6/c1-21(2)19(30)26-20(31)27(21)11-16(28(32)13-29)12-33-17-7-3-14(4-8-17)15-5-9-18(10-6-15)34-22(23,24)25/h3-10,13,16,32H,11-12H2,1-2H3,(H,26,30,31)
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n/an/a 4.60E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50084661
PNG
(4-(4'-Chloro-biphenyl-4-yl)-4-oxo-2-phenylsulfanyl...)
Show SMILES OC(=O)[C@@H](CSc1ccccc1)CC(=O)c1ccc(cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C23H19ClO3S/c24-20-12-10-17(11-13-20)16-6-8-18(9-7-16)22(25)14-19(23(26)27)15-28-21-4-2-1-3-5-21/h1-13,19H,14-15H2,(H,26,27)/t19-/m1/s1
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n/an/a>5.00E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108150
PNG
(CHEMBL75567 | N-{1-Dimethylaminomethyl-2-[4-(4-tri...)
Show SMILES CN(C)CC(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C19H21F3N2O6S/c1-23(2)11-14(24(26)13-25)12-31(27,28)18-9-7-16(8-10-18)29-15-3-5-17(6-4-15)30-19(20,21)22/h3-10,13-14,26H,11-12H2,1-2H3
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n/an/a 5.20E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108135
PNG
(2-(Formyl-hydroxy-amino)-3-[4-(4-trifluoromethoxy-...)
Show SMILES CN(C)S(=O)(=O)CC(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C19H21F3N2O8S2/c1-23(2)34(29,30)12-14(24(26)13-25)11-33(27,28)18-9-7-16(8-10-18)31-15-3-5-17(6-4-15)32-19(20,21)22/h3-10,13-14,26H,11-12H2,1-2H3
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n/an/a 6.60E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108160
PNG
(CHEMBL74151 | N-Hydroxy-N-{1-(thiophen-2-ylsulfany...)
Show SMILES ON(C=O)C(CSc1cccs1)CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C21H18F3NO6S3/c22-21(23,24)31-18-5-3-16(4-6-18)30-17-7-9-19(10-8-17)34(28,29)13-15(25(27)14-26)12-33-20-2-1-11-32-20/h1-11,14-15,27H,12-13H2
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n/an/a 6.70E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108161
PNG
(CHEMBL3037894 | N-Hydroxy-N-{1-(1-methanesulfonyl-...)
Show SMILES CS(=O)(=O)N1CCC[C@H]1[C@@H](CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C21H23F3N2O8S2/c1-35(29,30)26-12-2-3-19(26)20(25(28)14-27)13-36(31,32)18-10-8-16(9-11-18)33-15-4-6-17(7-5-15)34-21(22,23)24/h4-11,14,19-20,28H,2-3,12-13H2,1H3
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n/an/a 8.00E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108148
PNG
(CHEMBL75464 | N-{1-(2,2-Diethyl-[1,3]dioxolan-4-yl...)
Show SMILES CCC1(CC)OCC(O1)[C@@H](CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C23H26F3NO8S/c1-3-22(4-2)32-13-21(35-22)20(27(29)15-28)14-36(30,31)19-11-9-17(10-12-19)33-16-5-7-18(8-6-16)34-23(24,25)26/h5-12,15,20-21,29H,3-4,13-14H2,1-2H3/t20-,21?/m1/s1
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n/an/a 8.30E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108146
PNG
(CHEMBL307372 | N-Hydroxy-N-{1-(3-methyl-2,6-dioxo-...)
Show SMILES Cn1ccc(=O)n(CC(CS(=O)(=O)c2ccc(Oc3ccc(OC(F)(F)F)cc3)cc2)N(O)C=O)c1=O
Show InChI InChI=1S/C22H20F3N3O8S/c1-26-11-10-20(30)27(21(26)31)12-15(28(32)14-29)13-37(33,34)19-8-6-17(7-9-19)35-16-2-4-18(5-3-16)36-22(23,24)25/h2-11,14-15,32H,12-13H2,1H3
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n/an/a 9.90E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-7 (MMP7)


(Homo sapiens (Human))
BDBM50409487
PNG
(CHEMBL2115165)
Show SMILES CC1(C)OC[C@@H](O1)[C@@H](CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C21H22F3NO8S/c1-20(2)30-11-19(33-20)18(25(27)13-26)12-34(28,29)17-9-7-15(8-10-17)31-14-3-5-16(6-4-14)32-21(22,23)24/h3-10,13,18-19,27H,11-12H2,1-2H3/t18-,19-/m1/s1
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n/an/a 1.10E+4n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Matrix metalloprotease-7 (MMP-7) in fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108167
PNG
(CHEMBL306301 | N-{1-(2,2-Dimethyl-[1,3]dioxolan-4-...)
Show SMILES CC1(C)OCC(C[C@@H](CS(=O)(=O)c2ccc(Oc3ccc(OC(F)(F)F)cc3)cc2)N(O)C=O)O1
Show InChI InChI=1S/C22H24F3NO8S/c1-21(2)31-12-19(33-21)11-15(26(28)14-27)13-35(29,30)20-9-7-17(8-10-20)32-16-3-5-18(6-4-16)34-22(23,24)25/h3-10,14-15,19,28H,11-13H2,1-2H3/t15-,19?/m0/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108155
PNG
(CHEMBL73928 | N-Hydroxy-N-{1-pyridin-2-yl-2-[4-(4-...)
Show SMILES ON(C=O)C(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)c1ccccn1
Show InChI InChI=1S/C21H17F3N2O6S/c22-21(23,24)32-17-6-4-15(5-7-17)31-16-8-10-18(11-9-16)33(29,30)13-20(26(28)14-27)19-3-1-2-12-25-19/h1-12,14,20,28H,13H2
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n/an/a>5.00E+4n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108139
PNG
(CHEMBL74365 | N-Hydroxy-N-[2-[4-(4-trifluoromethox...)
Show SMILES ON(C=O)C(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C23H17F6NO6S/c24-22(25,26)16-3-1-15(2-4-16)21(30(32)14-31)13-37(33,34)20-11-9-18(10-12-20)35-17-5-7-19(8-6-17)36-23(27,28)29/h1-12,14,21,32H,13H2
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108145
PNG
(CHEMBL77907 | N-Hydroxy-N-[2-[4-(4-trifluoromethox...)
Show SMILES CN1C(=O)N(CC(CS(=O)(=O)c2ccc(Oc3ccc(OC(F)(F)F)cc3)cc2)N(O)C=O)C(=O)C1(C)C
Show InChI InChI=1S/C23H24F3N3O8S/c1-22(2)20(31)28(21(32)27(22)3)12-15(29(33)14-30)13-38(34,35)19-10-8-17(9-11-19)36-16-4-6-18(7-5-16)37-23(24,25)26/h4-11,14-15,33H,12-13H2,1-3H3
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108147
PNG
(CHEMBL75114 | N-Hydroxy-N-{1-(tetrahydro-furan-2-y...)
Show SMILES ON(C=O)C(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)C1CCCO1
Show InChI InChI=1S/C20H20F3NO7S/c21-20(22,23)31-16-5-3-14(4-6-16)30-15-7-9-17(10-8-15)32(27,28)12-18(24(26)13-25)19-2-1-11-29-19/h3-10,13,18-19,26H,1-2,11-12H2
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n/an/a 5.00E+4n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108138
PNG
(CHEMBL78052 | N-Hydroxy-N-{3-(4-methanesulfonyl-pi...)
Show SMILES CS(=O)(=O)N1CCN(CCC(CS(=O)(=O)c2ccc(Oc3ccc(OC(F)(F)F)cc3)cc2)N(O)C=O)CC1
Show InChI InChI=1S/C23H28F3N3O8S2/c1-38(32,33)28-14-12-27(13-15-28)11-10-18(29(31)17-30)16-39(34,35)22-8-6-20(7-9-22)36-19-2-4-21(5-3-19)37-23(24,25)26/h2-9,17-18,31H,10-16H2,1H3
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n/an/a 5.00E+4n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108149
PNG
(CHEMBL75189 | N-Hydroxy-N-{3-morpholin-4-yl-1-[4-(...)
Show SMILES ON(C=O)C(CCN1CCOCC1)CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C22H25F3N2O7S/c23-22(24,25)34-20-3-1-18(2-4-20)33-19-5-7-21(8-6-19)35(30,31)15-17(27(29)16-28)9-10-26-11-13-32-14-12-26/h1-8,16-17,29H,9-15H2
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108171
PNG
(CHEMBL77874 | N-Hydroxy-N-{3-hydroxy-2-hydroxymeth...)
Show SMILES OCC(CO)C(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C19H20F3NO8S/c20-19(21,22)31-16-3-1-14(2-4-16)30-15-5-7-17(8-6-15)32(28,29)11-18(23(27)12-26)13(9-24)10-25/h1-8,12-13,18,24-25,27H,9-11H2
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108156
PNG
(CHEMBL73866 | N-Hydroxy-N-{1-methoxymethyl-2-[4-(4...)
Show SMILES COCC(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C18H18F3NO7S/c1-27-10-13(22(24)12-23)11-30(25,26)17-8-6-15(7-9-17)28-14-2-4-16(5-3-14)29-18(19,20)21/h2-9,12-13,24H,10-11H2,1H3
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108153
PNG
(CHEMBL306276 | N-{1-(1,4-Dioxa-spiro[4.5]dec-8-yl)...)
Show SMILES ON(C=O)C(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)C1CCC2(CC1)OCCO2
Show InChI InChI=1S/C24H26F3NO8S/c25-24(26,27)36-20-3-1-18(2-4-20)35-19-5-7-21(8-6-19)37(31,32)15-22(28(30)16-29)17-9-11-23(12-10-17)33-13-14-34-23/h1-8,16-17,22,30H,9-15H2
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108170
PNG
(CHEMBL307915 | N-Hydroxy-N-{1-phenyl-2-[4-(4-trifl...)
Show SMILES ON(C=O)C(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)c1ccccc1
Show InChI InChI=1S/C22H18F3NO6S/c23-22(24,25)32-19-8-6-17(7-9-19)31-18-10-12-20(13-11-18)33(29,30)14-21(26(28)15-27)16-4-2-1-3-5-16/h1-13,15,21,28H,14H2
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108133
PNG
(CHEMBL74812 | N-Hydroxy-N-{1-(1-methyl-1H-indol-2-...)
Show SMILES Cn1c(cc2ccccc12)C(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C25H21F3N2O6S/c1-29-22-5-3-2-4-17(22)14-23(29)24(30(32)16-31)15-37(33,34)21-12-10-19(11-13-21)35-18-6-8-20(9-7-18)36-25(26,27)28/h2-14,16,24,32H,15H2,1H3
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108165
PNG
(CHEMBL306050 | N-Hydroxy-N-[2-[4-(4-trifluorometho...)
Show SMILES C[C@@H]1OC(C)(C)OC1[C@@H](CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C22H24F3NO8S/c1-14-20(34-21(2,3)32-14)19(26(28)13-27)12-35(29,30)18-10-8-16(9-11-18)31-15-4-6-17(7-5-15)33-22(23,24)25/h4-11,13-14,19-20,28H,12H2,1-3H3/t14-,19+,20?/m0/s1
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108151
PNG
(CHEMBL75164 | N-{2,3-Dihydroxy-1-[4-(4-trifluorome...)
Show SMILES OC[C@@H](O)C(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C18H18F3NO8S/c19-18(20,21)30-14-3-1-12(2-4-14)29-13-5-7-15(8-6-13)31(27,28)10-16(17(25)9-23)22(26)11-24/h1-8,11,16-17,23,25-26H,9-10H2/t16?,17-/m1/s1
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108134
PNG
(CHEMBL306585 | N-Hydroxy-N-{4-morpholin-4-yl-4-oxo...)
Show SMILES ON(C=O)C(CCC(=O)N1CCOCC1)CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C23H25F3N2O8S/c24-23(25,26)36-20-4-2-18(3-5-20)35-19-6-8-21(9-7-19)37(32,33)15-17(28(31)16-29)1-10-22(30)27-11-13-34-14-12-27/h2-9,16-17,31H,1,10-15H2
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50409487
PNG
(CHEMBL2115165)
Show SMILES CC1(C)OC[C@@H](O1)[C@@H](CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C21H22F3NO8S/c1-20(2)30-11-19(33-20)18(25(27)13-26)12-34(28,29)17-9-7-15(8-10-17)31-14-3-5-16(6-4-14)32-21(22,23)24/h3-10,13,18-19,27H,11-12H2,1-2H3/t18-,19-/m1/s1
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Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108136
PNG
(4-{3-(Formyl-hydroxy-amino)-4-[4-(4-trifluorometho...)
Show SMILES COC(=O)c1ccc(CCC(CS(=O)(=O)c2ccc(Oc3ccc(OC(F)(F)F)cc3)cc2)N(O)C=O)cc1
Show InChI InChI=1S/C26H24F3NO8S/c1-36-25(32)19-5-2-18(3-6-19)4-7-20(30(33)17-31)16-39(34,35)24-14-12-22(13-15-24)37-21-8-10-23(11-9-21)38-26(27,28)29/h2-3,5-6,8-15,17,20,33H,4,7,16H2,1H3
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n/an/a>5.00E+4n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108143
PNG
(4-{3-(Formyl-hydroxy-amino)-4-[4-(4-trifluorometho...)
Show SMILES ON(C=O)C(CCc1ccc(cc1)C(O)=O)CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C25H22F3NO8S/c26-25(27,28)37-22-9-7-20(8-10-22)36-21-11-13-23(14-12-21)38(34,35)15-19(29(33)16-30)6-3-17-1-4-18(5-2-17)24(31)32/h1-2,4-5,7-14,16,19,33H,3,6,15H2,(H,31,32)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50108163
PNG
(CHEMBL309329 | N-Hydroxy-N-{1-(2-hydroxy-ethoxymet...)
Show SMILES OCCOCC(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C19H20F3NO8S/c20-19(21,22)31-17-3-1-15(2-4-17)30-16-5-7-18(8-6-16)32(27,28)12-14(23(26)13-25)11-29-10-9-24/h1-8,13-14,24,26H,9-12H2
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n/an/a>5.00E+4n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50024168
PNG
(CHEMBL2114138)
Show SMILES CC1(C)OC[C@H](O1)[C@@H](CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)N(O)C=O
Show InChI InChI=1S/C21H22F3NO8S/c1-20(2)30-11-19(33-20)18(25(27)13-26)12-34(28,29)17-9-7-15(8-10-17)31-14-3-5-16(6-4-14)32-21(22,23)24/h3-10,13,18-19,27H,11-12H2,1-2H3/t18-,19+/m1/s1
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n/an/a 5.00E+4n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro selective inhibition against matrix metalloprotease-1 (MMP-1) using a fluorimetric assay


J Med Chem 45: 219-32 (2001)


Article DOI: 10.1021/jm0103920
BindingDB Entry DOI: 10.7270/Q2XP747B
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%