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Compile Data Set for Download or QSAR

Found 62 hits of ph data with Target = 'Matrix metalloproteinase-12 (MMP12)'   
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
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM92441
PNG
(RXP470, 1 | RXP470, Compound 4)
Show SMILES NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)C(Cc1cc(no1)-c1ccc(cc1)-c1cccc(Cl)c1)CP(O)(=O)c1ccc(Br)cc1
Show InChI InChI=1S/C35H35BrClN4O10P/c36-24-8-10-27(11-9-24)52(49,50)19-23(34(47)40-29(13-15-32(44)45)35(48)39-28(33(38)46)12-14-31(42)43)17-26-18-30(41-51-26)21-6-4-20(5-7-21)22-2-1-3-25(37)16-22/h1-11,16,18,23,28-29H,12-15,17,19H2,(H2,38,46)(H,39,48)(H,40,47)(H,42,43)(H,44,45)(H,49,50)/t23?,28-,29+/m1/s1
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0.190 -55.5n/an/an/an/an/a6.825



Commissariat à l'Energie Atomique



Assay Description
Enzyme assay using matrix metalloproteinases.


J Biol Chem 285: 35900-9 (2010)


Article DOI: 10.1074/jbc.M110.139634
BindingDB Entry DOI: 10.7270/Q25X27HV
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM92441
PNG
(RXP470, 1 | RXP470, Compound 4)
Show SMILES NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)C(Cc1cc(no1)-c1ccc(cc1)-c1cccc(Cl)c1)CP(O)(=O)c1ccc(Br)cc1
Show InChI InChI=1S/C35H35BrClN4O10P/c36-24-8-10-27(11-9-24)52(49,50)19-23(34(47)40-29(13-15-32(44)45)35(48)39-28(33(38)46)12-14-31(42)43)17-26-18-30(41-51-26)21-6-4-20(5-7-21)22-2-1-3-25(37)16-22/h1-11,16,18,23,28-29H,12-15,17,19H2,(H2,38,46)(H,39,48)(H,40,47)(H,42,43)(H,44,45)(H,49,50)/t23?,28-,29+/m1/s1
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0.200 -55.4n/an/an/an/an/a6.825



Commissariat á l'Energie Atomique



Assay Description
Enzyme assay using human matrix metalloproteases or ADAMTS.


J Biol Chem 287: 26647-56 (2012)


Article DOI: 10.1074/jbc.M112.380782
BindingDB Entry DOI: 10.7270/Q2H993SB
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM92443
PNG
(MMP Inhibitor, 3 | Thiophene derivative, compound ...)
Show SMILES NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cc(cs1)-c1ccccc1
Show InChI InChI=1S/C29H31N3O7S/c30-28(38)22(11-14-26(34)35)32-29(39)23(12-15-27(36)37)31-25(33)13-8-18-6-9-20(10-7-18)24-16-21(17-40-24)19-4-2-1-3-5-19/h1-7,9-10,16-17,22-23H,8,11-15H2,(H2,30,38)(H,31,33)(H,32,39)(H,34,35)(H,36,37)/t22-,23+/m1/s1
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1.90 -49.8n/an/an/an/an/a6.825



Commissariat á l'Energie Atomique



Assay Description
Enzyme assay using human matrix metalloproteases or ADAMTS.


J Biol Chem 287: 26647-56 (2012)


Article DOI: 10.1074/jbc.M112.380782
BindingDB Entry DOI: 10.7270/Q2H993SB
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM92443
PNG
(MMP Inhibitor, 3 | Thiophene derivative, compound ...)
Show SMILES NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cc(cs1)-c1ccccc1
Show InChI InChI=1S/C29H31N3O7S/c30-28(38)22(11-14-26(34)35)32-29(39)23(12-15-27(36)37)31-25(33)13-8-18-6-9-20(10-7-18)24-16-21(17-40-24)19-4-2-1-3-5-19/h1-7,9-10,16-17,22-23H,8,11-15H2,(H2,30,38)(H,31,33)(H,32,39)(H,34,35)(H,36,37)/t22-,23+/m1/s1
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1.92 -49.8n/an/an/an/an/a6.825



Commissariat à l'Energie Atomique



Assay Description
Enzyme assay using matrix metalloproteinases.


J Biol Chem 285: 35900-9 (2010)


Article DOI: 10.1074/jbc.M110.139634
BindingDB Entry DOI: 10.7270/Q25X27HV
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM92446
PNG
(Inhibitor, 16)
Show SMILES NC(=O)[C@H](CCC(O)=O)NC(=O)c1ccc(cc1)-c1cc(cs1)-c1ccccc1
Show InChI InChI=1S/C22H20N2O4S/c23-21(27)18(10-11-20(25)26)24-22(28)16-8-6-15(7-9-16)19-12-17(13-29-19)14-4-2-1-3-5-14/h1-9,12-13,18H,10-11H2,(H2,23,27)(H,24,28)(H,25,26)/t18-/m0/s1
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2.5 -49.1n/an/an/an/an/a6.825



Commissariat á l'Energie Atomique



Assay Description
Enzyme assay using human matrix metalloproteases or ADAMTS.


J Biol Chem 287: 26647-56 (2012)


Article DOI: 10.1074/jbc.M112.380782
BindingDB Entry DOI: 10.7270/Q2H993SB
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM92449
PNG
(Inhibitor, 19)
Show SMILES NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccc(s1)-c1ccccc1
Show InChI InChI=1S/C24H24N2O4S/c25-24(30)19(11-15-23(28)29)26-22(27)14-8-16-6-9-18(10-7-16)21-13-12-20(31-21)17-4-2-1-3-5-17/h1-7,9-10,12-13,19H,8,11,14-15H2,(H2,25,30)(H,26,27)(H,28,29)/t19-/m0/s1
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2.90 -48.7n/an/an/an/an/a6.825



Commissariat á l'Energie Atomique



Assay Description
Enzyme assay using human matrix metalloproteases or ADAMTS.


J Biol Chem 287: 26647-56 (2012)


Article DOI: 10.1074/jbc.M112.380782
BindingDB Entry DOI: 10.7270/Q2H993SB
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM92447
PNG
(Inhibitor, 17)
Show SMILES Cc1ccc(s1)-c1ccc(CCC(=O)N[C@@H](CCC(O)=O)C(N)=O)cc1
Show InChI InChI=1S/C19H22N2O4S/c1-12-2-9-16(26-12)14-6-3-13(4-7-14)5-10-17(22)21-15(19(20)25)8-11-18(23)24/h2-4,6-7,9,15H,5,8,10-11H2,1H3,(H2,20,25)(H,21,22)(H,23,24)/t15-/m0/s1
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3.30 -48.4n/an/an/an/an/a6.825



Commissariat á l'Energie Atomique



Assay Description
Enzyme assay using human matrix metalloproteases or ADAMTS.


J Biol Chem 287: 26647-56 (2012)


Article DOI: 10.1074/jbc.M112.380782
BindingDB Entry DOI: 10.7270/Q2H993SB
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM92448
PNG
(Inhibitor, 18)
Show SMILES NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C26H26N2O4/c27-26(32)23(15-17-25(30)31)28-24(29)16-8-18-6-9-20(10-7-18)22-13-11-21(12-14-22)19-4-2-1-3-5-19/h1-7,9-14,23H,8,15-17H2,(H2,27,32)(H,28,29)(H,30,31)/t23-/m0/s1
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3.30 -48.4n/an/an/an/an/a6.825



Commissariat á l'Energie Atomique



Assay Description
Enzyme assay using human matrix metalloproteases or ADAMTS.


J Biol Chem 287: 26647-56 (2012)


Article DOI: 10.1074/jbc.M112.380782
BindingDB Entry DOI: 10.7270/Q2H993SB
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM92445
PNG
(Inhibitor, 10 | US8691753, 105)
Show SMILES NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cc(cs1)-c1ccccc1
Show InChI InChI=1S/C24H24N2O4S/c25-24(30)20(11-13-23(28)29)26-22(27)12-8-16-6-9-18(10-7-16)21-14-19(15-31-21)17-4-2-1-3-5-17/h1-7,9-10,14-15,20H,8,11-13H2,(H2,25,30)(H,26,27)(H,28,29)/t20-/m0/s1
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3.60 -48.2n/an/an/an/an/a6.825



Commissariat á l'Energie Atomique



Assay Description
Enzyme assay using human matrix metalloproteases or ADAMTS.


J Biol Chem 287: 26647-56 (2012)


Article DOI: 10.1074/jbc.M112.380782
BindingDB Entry DOI: 10.7270/Q2H993SB
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM27878
PNG
(13-(carbamoylmethyl)-3-oxo-N-[(3-oxo-3,4-dihydro-2...)
Show SMILES NC(=O)CC1CCCc2sc3nc([nH]c(=O)c3c12)C(=O)NCc1ccc2OCC(=O)Nc2c1
Show InChI InChI=1S/C22H21N5O5S/c23-15(28)7-11-2-1-3-14-17(11)18-20(30)26-19(27-22(18)33-14)21(31)24-8-10-4-5-13-12(6-10)25-16(29)9-32-13/h4-6,11H,1-3,7-9H2,(H2,23,28)(H,24,31)(H,25,29)(H,26,27,30)
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n/an/a>1.00E+4n/an/an/an/a6.825



Commissariat á l'Energie Atomique



Assay Description
Enzyme assay using human matrix metalloproteases or ADAMTS.


J Biol Chem 287: 26647-56 (2012)


Article DOI: 10.1074/jbc.M112.380782
BindingDB Entry DOI: 10.7270/Q2H993SB
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM92442
PNG
(MMP Inhibitor, 2)
Show SMILES CC(C)C(NS(=O)(=O)c1ccc2c(c1)oc1ccc(cc21)N1CCOC1=O)C(O)=O
Show InChI InChI=1S/C20H20N2O7S/c1-11(2)18(19(23)24)21-30(26,27)13-4-5-14-15-9-12(22-7-8-28-20(22)25)3-6-16(15)29-17(14)10-13/h3-6,9-11,18,21H,7-8H2,1-2H3,(H,23,24)
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n/an/a 1.40n/an/an/an/a6.825



Commissariat á l'Energie Atomique



Assay Description
Enzyme assay using human matrix metalloproteases or ADAMTS.


J Biol Chem 287: 26647-56 (2012)


Article DOI: 10.1074/jbc.M112.380782
BindingDB Entry DOI: 10.7270/Q2H993SB
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM29017
PNG
((1S,5S,7R)-N-hydroxy-3-[(4-phenylphenyl)methyl]-6,...)
Show SMILES ONC(=O)[C@@H]1O[C@H]2CN(Cc3ccc(cc3)-c3ccccc3)C[C@@H]1O2
Show InChI InChI=1S/C19H20N2O4/c22-19(20-23)18-16-11-21(12-17(24-16)25-18)10-13-6-8-15(9-7-13)14-4-2-1-3-5-14/h1-9,16-18,23H,10-12H2,(H,20,22)/t16-,17-,18+/m0/s1
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n/an/a 3.99E+5>5.00E+5n/an/an/a7.025



University of Florence



Assay Description
The NMR experiments were performed to determine the binding affinity (KD) for the MMP-12 catalytic domain. The alteration of the chemical shifts indu...


Bioorg Med Chem 14: 7392-403 (2006)


Article DOI: 10.1016/j.bmc.2006.07.028
BindingDB Entry DOI: 10.7270/Q2TD9VPX
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM29014
PNG
((1R,5S,7R)-2-oxo-3-[(4-phenylphenyl)methyl]-6,8-di...)
Show SMILES OC(=O)[C@@H]1O[C@H]2CN(Cc3ccc(cc3)-c3ccccc3)C(=O)[C@@H]1O2
Show InChI InChI=1S/C19H17NO5/c21-18-16-17(19(22)23)25-15(24-16)11-20(18)10-12-6-8-14(9-7-12)13-4-2-1-3-5-13/h1-9,15-17H,10-11H2,(H,22,23)/t15-,16+,17+/m0/s1
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n/an/a 9.54E+5>1.00E+6n/an/an/a7.025



University of Florence



Assay Description
The NMR experiments were performed to determine the binding affinity (KD) for the MMP-12 catalytic domain. The alteration of the chemical shifts indu...


Bioorg Med Chem 14: 7392-403 (2006)


Article DOI: 10.1016/j.bmc.2006.07.028
BindingDB Entry DOI: 10.7270/Q2TD9VPX
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM29018
PNG
((1S,5S,7R)-3-N-hydroxy-7-N-[(4-phenylphenyl)methyl...)
Show SMILES ONC(=O)N1C[C@H]2O[C@@H](C1)[C@@H](O2)C(=O)NCc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C20H21N3O5/c24-19(18-16-11-23(20(25)22-26)12-17(27-16)28-18)21-10-13-6-8-15(9-7-13)14-4-2-1-3-5-14/h1-9,16-18,26H,10-12H2,(H,21,24)(H,22,25)/t16-,17-,18+/m0/s1
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n/an/a 1.49E+5 1.54E+5n/an/an/a7.025



University of Florence



Assay Description
The NMR experiments were performed to determine the binding affinity (KD) for the MMP-12 catalytic domain. The alteration of the chemical shifts indu...


Bioorg Med Chem 14: 7392-403 (2006)


Article DOI: 10.1016/j.bmc.2006.07.028
BindingDB Entry DOI: 10.7270/Q2TD9VPX
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM29015
PNG
((1S,5S,7R)-3-[(4-phenylphenyl)methyl]-6,8-dioxa-3-...)
Show SMILES OC(=O)[C@@H]1O[C@H]2CN(Cc3ccc(cc3)-c3ccccc3)C[C@@H]1O2
Show InChI InChI=1S/C19H19NO4/c21-19(22)18-16-11-20(12-17(23-16)24-18)10-13-6-8-15(9-7-13)14-4-2-1-3-5-14/h1-9,16-18H,10-12H2,(H,21,22)/t16-,17-,18+/m0/s1
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n/an/a 8.35E+5>1.00E+6n/an/an/a7.025



University of Florence



Assay Description
The NMR experiments were performed to determine the binding affinity (KD) for the MMP-12 catalytic domain. The alteration of the chemical shifts indu...


Bioorg Med Chem 14: 7392-403 (2006)


Article DOI: 10.1016/j.bmc.2006.07.028
BindingDB Entry DOI: 10.7270/Q2TD9VPX
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM29018
PNG
((1S,5S,7R)-3-N-hydroxy-7-N-[(4-phenylphenyl)methyl...)
Show SMILES ONC(=O)N1C[C@H]2O[C@@H](C1)[C@@H](O2)C(=O)NCc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C20H21N3O5/c24-19(18-16-11-23(20(25)22-26)12-17(27-16)28-18)21-10-13-6-8-15(9-7-13)14-4-2-1-3-5-14/h1-9,16-18,26H,10-12H2,(H,21,24)(H,22,25)/t16-,17-,18+/m0/s1
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n/an/a 1.49E+5n/an/an/an/a7.025



University of Florence



Assay Description
The inhibition potency (IC50) was measured by fluorescent enzymatic assays. The compounds were evaluated for their ability to inhibit the hydrolysis ...


Bioorg Med Chem 14: 7392-403 (2006)


Article DOI: 10.1016/j.bmc.2006.07.028
BindingDB Entry DOI: 10.7270/Q2TD9VPX
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM29016
PNG
((1R,5S,7R)-N-hydroxy-2-oxo-3-[(4-phenylphenyl)meth...)
Show SMILES ONC(=O)[C@@H]1O[C@H]2CN(Cc3ccc(cc3)-c3ccccc3)C(=O)[C@@H]1O2
Show InChI InChI=1S/C19H18N2O5/c22-18(20-24)16-17-19(23)21(11-15(25-16)26-17)10-12-6-8-14(9-7-12)13-4-2-1-3-5-13/h1-9,15-17,24H,10-11H2,(H,20,22)/t15-,16-,17-/m1/s1
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n/an/a 4.25E+5>5.00E+5n/an/an/a7.025



University of Florence



Assay Description
The NMR experiments were performed to determine the binding affinity (KD) for the MMP-12 catalytic domain. The alteration of the chemical shifts indu...


Bioorg Med Chem 14: 7392-403 (2006)


Article DOI: 10.1016/j.bmc.2006.07.028
BindingDB Entry DOI: 10.7270/Q2TD9VPX
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM29022
PNG
(ethyl 1-(hydroxycarbamoyl)piperidine-4-carboxylate...)
Show SMILES CCOC(=O)C1CCN(CC1)C(=O)NO
Show InChI InChI=1S/C9H16N2O4/c1-2-15-8(12)7-3-5-11(6-4-7)9(13)10-14/h7,14H,2-6H2,1H3,(H,10,13)
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n/an/an/a 3.40E+6n/an/an/a7.225



University of Florence



Assay Description
The NMR experiments were performed to determine the binding affinity (KD) for the MMP-12 catalytic domain. The alteration of the chemical shifts indu...


Bioorg Med Chem 14: 7392-403 (2006)


Article DOI: 10.1016/j.bmc.2006.07.028
BindingDB Entry DOI: 10.7270/Q2TD9VPX
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM29023
PNG
((1S,5R)-3-[(4-phenylphenyl)methyl]-6,8-dioxa-3-aza...)
Show SMILES OC(=O)C1[C@@H]2OC[C@H](CN1Cc1ccc(cc1)-c1ccccc1)O2
Show InChI InChI=1S/C19H19NO4/c21-18(22)17-19-23-12-16(24-19)11-20(17)10-13-6-8-15(9-7-13)14-4-2-1-3-5-14/h1-9,16-17,19H,10-12H2,(H,21,22)/t16-,17?,19+/m0/s1
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n/an/an/an/an/an/an/a7.225



University of Florence



Assay Description
The NMR experiments were performed to determine the binding affinity (KD) for the MMP-12 catalytic domain. The alteration of the chemical shifts indu...


Bioorg Med Chem 14: 7392-403 (2006)


Article DOI: 10.1016/j.bmc.2006.07.028
BindingDB Entry DOI: 10.7270/Q2TD9VPX
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM29020
PNG
((1S,5S,7R)-3-benzyl-6,8-dioxa-3-azabicyclo[3.2.1]o...)
Show SMILES OC(=O)[C@@H]1O[C@H]2CN(Cc3ccccc3)C[C@@H]1O2
Show InChI InChI=1S/C13H15NO4/c15-13(16)12-10-7-14(8-11(17-10)18-12)6-9-4-2-1-3-5-9/h1-5,10-12H,6-8H2,(H,15,16)/t10-,11-,12+/m0/s1
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n/an/an/a>1.00E+7n/an/an/a7.225



University of Florence



Assay Description
The NMR experiments were performed to determine the binding affinity (KD) for the MMP-12 catalytic domain. The alteration of the chemical shifts indu...


Bioorg Med Chem 14: 7392-403 (2006)


Article DOI: 10.1016/j.bmc.2006.07.028
BindingDB Entry DOI: 10.7270/Q2TD9VPX
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM29021
PNG
((1R,5S,7R)-3-benzyl-N-hydroxy-2-oxo-6,8-dioxa-3-az...)
Show SMILES ONC(=O)[C@@H]1O[C@H]2CN(Cc3ccccc3)C(=O)[C@@H]1O2
Show InChI InChI=1S/C13H14N2O5/c16-12(14-18)10-11-13(17)15(7-9(19-10)20-11)6-8-4-2-1-3-5-8/h1-5,9-11,18H,6-7H2,(H,14,16)/t9-,10-,11-/m1/s1
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n/an/an/a>1.00E+7n/an/an/a7.225



University of Florence



Assay Description
The NMR experiments were performed to determine the binding affinity (KD) for the MMP-12 catalytic domain. The alteration of the chemical shifts indu...


Bioorg Med Chem 14: 7392-403 (2006)


Article DOI: 10.1016/j.bmc.2006.07.028
BindingDB Entry DOI: 10.7270/Q2TD9VPX
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM29019
PNG
((1R,5S,7R)-3-benzyl-2-oxo-6,8-dioxa-3-azabicyclo[3...)
Show SMILES OC(=O)[C@@H]1O[C@H]2CN(Cc3ccccc3)C(=O)[C@@H]1O2
Show InChI InChI=1S/C13H13NO5/c15-12-10-11(13(16)17)19-9(18-10)7-14(12)6-8-4-2-1-3-5-8/h1-5,9-11H,6-7H2,(H,16,17)/t9-,10+,11+/m0/s1
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n/an/an/a>1.00E+7n/an/an/a7.225



University of Florence



Assay Description
The NMR experiments were performed to determine the binding affinity (KD) for the MMP-12 catalytic domain. The alteration of the chemical shifts indu...


Bioorg Med Chem 14: 7392-403 (2006)


Article DOI: 10.1016/j.bmc.2006.07.028
BindingDB Entry DOI: 10.7270/Q2TD9VPX
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM28468
PNG
((2S)-2-({12-bromo-11-[(methoxycarbonyl)amino]-8-ox...)
Show SMILES COC(=O)Nc1cc2oc3ccc(cc3c2cc1Br)S(=O)(=O)N[C@@H](C(C)C)C(O)=O
Show InChI InChI=1S/C19H19BrN2O7S/c1-9(2)17(18(23)24)22-30(26,27)10-4-5-15-11(6-10)12-7-13(20)14(8-16(12)29-15)21-19(25)28-3/h4-9,17,22H,1-3H3,(H,21,25)(H,23,24)/t17-/m0/s1
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n/an/a 3.90E+3n/an/an/an/a7.522



Wyeth Research



Assay Description
The assays for human MMP activity were performed by incubating fluorogenic peptide substrate with recombinant human MMP catalytic domain along with v...


J Med Chem 52: 1799-802 (2009)


Article DOI: 10.1021/jm900093d
BindingDB Entry DOI: 10.7270/Q2X928NP
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM28469
PNG
((2S)-2-({12-[(methoxycarbonyl)amino]-8-oxatricyclo...)
Show SMILES COC(=O)Nc1ccc2oc3cc(ccc3c2c1)S(=O)(=O)N[C@@H](C(C)C)C(O)=O
Show InChI InChI=1S/C19H20N2O7S/c1-10(2)17(18(22)23)21-29(25,26)12-5-6-13-14-8-11(20-19(24)27-3)4-7-15(14)28-16(13)9-12/h4-10,17,21H,1-3H3,(H,20,24)(H,22,23)/t17-/m0/s1
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n/an/a 2n/an/an/an/a7.522



Wyeth Research



Assay Description
The assays for human MMP activity were performed by incubating fluorogenic peptide substrate with recombinant human MMP catalytic domain along with v...


J Med Chem 52: 1799-802 (2009)


Article DOI: 10.1021/jm900093d
BindingDB Entry DOI: 10.7270/Q2X928NP
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM28470
PNG
((2S)-2-({12-[(ethoxycarbonyl)amino]-8-oxatricyclo[...)
Show SMILES CCOC(=O)Nc1ccc2oc3cc(ccc3c2c1)S(=O)(=O)N[C@@H](C(C)C)C(O)=O
Show InChI InChI=1S/C20H22N2O7S/c1-4-28-20(25)21-12-5-8-16-15(9-12)14-7-6-13(10-17(14)29-16)30(26,27)22-18(11(2)3)19(23)24/h5-11,18,22H,4H2,1-3H3,(H,21,25)(H,23,24)/t18-/m0/s1
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n/an/a 5n/an/an/an/a7.522



Wyeth Research



Assay Description
The assays for human MMP activity were performed by incubating fluorogenic peptide substrate with recombinant human MMP catalytic domain along with v...


J Med Chem 52: 1799-802 (2009)


Article DOI: 10.1021/jm900093d
BindingDB Entry DOI: 10.7270/Q2X928NP
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM28471
PNG
((2S)-3-methyl-2-({12-[(propoxycarbonyl)amino]-8-ox...)
Show SMILES CCCOC(=O)Nc1ccc2oc3cc(ccc3c2c1)S(=O)(=O)N[C@@H](C(C)C)C(O)=O
Show InChI InChI=1S/C21H24N2O7S/c1-4-9-29-21(26)22-13-5-8-17-16(10-13)15-7-6-14(11-18(15)30-17)31(27,28)23-19(12(2)3)20(24)25/h5-8,10-12,19,23H,4,9H2,1-3H3,(H,22,26)(H,24,25)/t19-/m0/s1
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Wyeth Research



Assay Description
The assays for human MMP activity were performed by incubating fluorogenic peptide substrate with recombinant human MMP catalytic domain along with v...


J Med Chem 52: 1799-802 (2009)


Article DOI: 10.1021/jm900093d
BindingDB Entry DOI: 10.7270/Q2X928NP
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM28472
PNG
((2S)-3-methyl-2-[(12-{[(2-methylpropoxy)carbonyl]a...)
Show SMILES CC(C)COC(=O)Nc1ccc2oc3cc(ccc3c2c1)S(=O)(=O)N[C@@H](C(C)C)C(O)=O
Show InChI InChI=1S/C22H26N2O7S/c1-12(2)11-30-22(27)23-14-5-8-18-17(9-14)16-7-6-15(10-19(16)31-18)32(28,29)24-20(13(3)4)21(25)26/h5-10,12-13,20,24H,11H2,1-4H3,(H,23,27)(H,25,26)/t20-/m0/s1
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n/an/a 4.70n/an/an/an/a7.522



Wyeth Research



Assay Description
The assays for human MMP activity were performed by incubating fluorogenic peptide substrate with recombinant human MMP catalytic domain along with v...


J Med Chem 52: 1799-802 (2009)


Article DOI: 10.1021/jm900093d
BindingDB Entry DOI: 10.7270/Q2X928NP
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM28473
PNG
((2S)-2-[(12-{[(2-fluoroethoxy)carbonyl]amino}-8-ox...)
Show SMILES CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(NC(=O)OCCF)cc21)C(O)=O
Show InChI InChI=1S/C20H21FN2O7S/c1-11(2)18(19(24)25)23-31(27,28)13-4-5-14-15-9-12(22-20(26)29-8-7-21)3-6-16(15)30-17(14)10-13/h3-6,9-11,18,23H,7-8H2,1-2H3,(H,22,26)(H,24,25)/t18-/m0/s1
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n/an/a 2.10n/an/an/an/a7.522



Wyeth Research



Assay Description
The assays for human MMP activity were performed by incubating fluorogenic peptide substrate with recombinant human MMP catalytic domain along with v...


J Med Chem 52: 1799-802 (2009)


Article DOI: 10.1021/jm900093d
BindingDB Entry DOI: 10.7270/Q2X928NP
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM28474
PNG
((2S)-3-methyl-2-({12-[(phenoxycarbonyl)amino]-8-ox...)
Show SMILES CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(NC(=O)Oc3ccccc3)cc21)C(O)=O
Show InChI InChI=1S/C24H22N2O7S/c1-14(2)22(23(27)28)26-34(30,31)17-9-10-18-19-12-15(8-11-20(19)33-21(18)13-17)25-24(29)32-16-6-4-3-5-7-16/h3-14,22,26H,1-2H3,(H,25,29)(H,27,28)/t22-/m0/s1
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n/an/a 10.2n/an/an/an/a7.522



Wyeth Research



Assay Description
The assays for human MMP activity were performed by incubating fluorogenic peptide substrate with recombinant human MMP catalytic domain along with v...


J Med Chem 52: 1799-802 (2009)


Article DOI: 10.1021/jm900093d
BindingDB Entry DOI: 10.7270/Q2X928NP
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM28475
PNG
((2S)-2-({12-[(2-chlorophenoxycarbonyl)amino]-8-oxa...)
Show SMILES CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(NC(=O)Oc3ccccc3Cl)cc21)C(O)=O
Show InChI InChI=1S/C24H21ClN2O7S/c1-13(2)22(23(28)29)27-35(31,32)15-8-9-16-17-11-14(7-10-19(17)33-21(16)12-15)26-24(30)34-20-6-4-3-5-18(20)25/h3-13,22,27H,1-2H3,(H,26,30)(H,28,29)/t22-/m0/s1
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n/an/a 6.60n/an/an/an/a7.522



Wyeth Research



Assay Description
The assays for human MMP activity were performed by incubating fluorogenic peptide substrate with recombinant human MMP catalytic domain along with v...


J Med Chem 52: 1799-802 (2009)


Article DOI: 10.1021/jm900093d
BindingDB Entry DOI: 10.7270/Q2X928NP
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM28476
PNG
((2S)-2-({12-[(4-fluorophenoxycarbonyl)amino]-8-oxa...)
Show SMILES CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(NC(=O)Oc3ccc(F)cc3)cc21)C(O)=O
Show InChI InChI=1S/C24H21FN2O7S/c1-13(2)22(23(28)29)27-35(31,32)17-8-9-18-19-11-15(5-10-20(19)34-21(18)12-17)26-24(30)33-16-6-3-14(25)4-7-16/h3-13,22,27H,1-2H3,(H,26,30)(H,28,29)/t22-/m0/s1
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n/an/a 8.10n/an/an/an/a7.522



Wyeth Research



Assay Description
The assays for human MMP activity were performed by incubating fluorogenic peptide substrate with recombinant human MMP catalytic domain along with v...


J Med Chem 52: 1799-802 (2009)


Article DOI: 10.1021/jm900093d
BindingDB Entry DOI: 10.7270/Q2X928NP
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM28477
PNG
((2S)-3-methyl-2-({12-[(4-methylphenoxycarbonyl)ami...)
Show SMILES CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(NC(=O)Oc3ccc(C)cc3)cc21)C(O)=O
Show InChI InChI=1S/C25H24N2O7S/c1-14(2)23(24(28)29)27-35(31,32)18-9-10-19-20-12-16(6-11-21(20)34-22(19)13-18)26-25(30)33-17-7-4-15(3)5-8-17/h4-14,23,27H,1-3H3,(H,26,30)(H,28,29)/t23-/m0/s1
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n/an/a 14n/an/an/an/a7.522



Wyeth Research



Assay Description
The assays for human MMP activity were performed by incubating fluorogenic peptide substrate with recombinant human MMP catalytic domain along with v...


J Med Chem 52: 1799-802 (2009)


Article DOI: 10.1021/jm900093d
BindingDB Entry DOI: 10.7270/Q2X928NP
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM28478
PNG
((2S)-2-{[12-(carbamoylamino)-8-oxatricyclo[7.4.0.0...)
Show SMILES CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(NC(N)=O)cc21)C(O)=O
Show InChI InChI=1S/C18H19N3O6S/c1-9(2)16(17(22)23)21-28(25,26)11-4-5-12-13-7-10(20-18(19)24)3-6-14(13)27-15(12)8-11/h3-9,16,21H,1-2H3,(H,22,23)(H3,19,20,24)/t16-/m0/s1
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Wyeth Research



Assay Description
The assays for human MMP activity were performed by incubating fluorogenic peptide substrate with recombinant human MMP catalytic domain along with v...


J Med Chem 52: 1799-802 (2009)


Article DOI: 10.1021/jm900093d
BindingDB Entry DOI: 10.7270/Q2X928NP
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM28479
PNG
((2S)-2-({12-[(cyclopentylcarbamoyl)amino]-8-oxatri...)
Show SMILES CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(NC(=O)NC3CCCC3)cc21)C(O)=O
Show InChI InChI=1S/C23H27N3O6S/c1-13(2)21(22(27)28)26-33(30,31)16-8-9-17-18-11-15(7-10-19(18)32-20(17)12-16)25-23(29)24-14-5-3-4-6-14/h7-14,21,26H,3-6H2,1-2H3,(H,27,28)(H2,24,25,29)/t21-/m0/s1
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Wyeth Research



Assay Description
The assays for human MMP activity were performed by incubating fluorogenic peptide substrate with recombinant human MMP catalytic domain along with v...


J Med Chem 52: 1799-802 (2009)


Article DOI: 10.1021/jm900093d
BindingDB Entry DOI: 10.7270/Q2X928NP
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM28480
PNG
((2S)-3-methyl-2-({12-[(thiophen-3-ylcarbamoyl)amin...)
Show SMILES CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(NC(=O)Nc3ccsc3)cc21)C(O)=O
Show InChI InChI=1S/C22H21N3O6S2/c1-12(2)20(21(26)27)25-33(29,30)15-4-5-16-17-9-13(3-6-18(17)31-19(16)10-15)23-22(28)24-14-7-8-32-11-14/h3-12,20,25H,1-2H3,(H,26,27)(H2,23,24,28)/t20-/m0/s1
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Wyeth Research



Assay Description
The assays for human MMP activity were performed by incubating fluorogenic peptide substrate with recombinant human MMP catalytic domain along with v...


J Med Chem 52: 1799-802 (2009)


Article DOI: 10.1021/jm900093d
BindingDB Entry DOI: 10.7270/Q2X928NP
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM28481
PNG
((2S)-3-methyl-2-{[12-({[2-(thiophen-2-yl)ethyl]car...)
Show SMILES CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(NC(=O)NCCc3cccs3)cc21)C(O)=O
Show InChI InChI=1S/C24H25N3O6S2/c1-14(2)22(23(28)29)27-35(31,32)17-6-7-18-19-12-15(5-8-20(19)33-21(18)13-17)26-24(30)25-10-9-16-4-3-11-34-16/h3-8,11-14,22,27H,9-10H2,1-2H3,(H,28,29)(H2,25,26,30)/t22-/m0/s1
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Wyeth Research



Assay Description
The assays for human MMP activity were performed by incubating fluorogenic peptide substrate with recombinant human MMP catalytic domain along with v...


J Med Chem 52: 1799-802 (2009)


Article DOI: 10.1021/jm900093d
BindingDB Entry DOI: 10.7270/Q2X928NP
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM28482
PNG
((2S)-2-({11-[(methoxycarbonyl)amino]-8-oxatricyclo...)
Show SMILES COC(=O)Nc1ccc2c(c1)oc1cc(ccc21)S(=O)(=O)N[C@@H](C(C)C)C(O)=O
Show InChI InChI=1S/C19H20N2O7S/c1-10(2)17(18(22)23)21-29(25,26)12-5-7-14-13-6-4-11(20-19(24)27-3)8-15(13)28-16(14)9-12/h4-10,17,21H,1-3H3,(H,20,24)(H,22,23)/t17-/m0/s1
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n/an/a 12n/an/an/an/a7.522



Wyeth Research



Assay Description
The assays for human MMP activity were performed by incubating fluorogenic peptide substrate with recombinant human MMP catalytic domain along with v...


J Med Chem 52: 1799-802 (2009)


Article DOI: 10.1021/jm900093d
BindingDB Entry DOI: 10.7270/Q2X928NP
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM28483
PNG
((2S)-2-[(11-{[(2-fluoroethoxy)carbonyl]amino}-8-ox...)
Show SMILES CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1cc(NC(=O)OCCF)ccc21)C(O)=O
Show InChI InChI=1S/C20H21FN2O7S/c1-11(2)18(19(24)25)23-31(27,28)13-4-6-15-14-5-3-12(22-20(26)29-8-7-21)9-16(14)30-17(15)10-13/h3-6,9-11,18,23H,7-8H2,1-2H3,(H,22,26)(H,24,25)/t18-/m0/s1
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n/an/a 10n/an/an/an/a7.522



Wyeth Research



Assay Description
The assays for human MMP activity were performed by incubating fluorogenic peptide substrate with recombinant human MMP catalytic domain along with v...


J Med Chem 52: 1799-802 (2009)


Article DOI: 10.1021/jm900093d
BindingDB Entry DOI: 10.7270/Q2X928NP
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM28484
PNG
((2S)-2-({11-[(4-fluorophenoxycarbonyl)amino]-8-oxa...)
Show SMILES CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1cc(NC(=O)Oc3ccc(F)cc3)ccc21)C(O)=O
Show InChI InChI=1S/C24H21FN2O7S/c1-13(2)22(23(28)29)27-35(31,32)17-8-10-19-18-9-5-15(11-20(18)34-21(19)12-17)26-24(30)33-16-6-3-14(25)4-7-16/h3-13,22,27H,1-2H3,(H,26,30)(H,28,29)/t22-/m0/s1
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n/an/a 16n/an/an/an/a7.522



Wyeth Research



Assay Description
The assays for human MMP activity were performed by incubating fluorogenic peptide substrate with recombinant human MMP catalytic domain along with v...


J Med Chem 52: 1799-802 (2009)


Article DOI: 10.1021/jm900093d
BindingDB Entry DOI: 10.7270/Q2X928NP
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM28467
PNG
((2R)-2-({12-bromo-11-[(methoxycarbonyl)amino]-8-ox...)
Show SMILES COC(=O)Nc1cc2oc3ccc(cc3c2cc1Br)S(=O)(=O)N[C@H](C(C)C)C(O)=O
Show InChI InChI=1S/C19H19BrN2O7S/c1-9(2)17(18(23)24)22-30(26,27)10-4-5-15-11(6-10)12-7-13(20)14(8-16(12)29-15)21-19(25)28-3/h4-9,17,22H,1-3H3,(H,21,25)(H,23,24)/t17-/m1/s1
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Wyeth Research



Assay Description
The assays for human MMP activity were performed by incubating fluorogenic peptide substrate with recombinant human MMP catalytic domain along with v...


J Med Chem 52: 1799-802 (2009)


Article DOI: 10.1021/jm900093d
BindingDB Entry DOI: 10.7270/Q2X928NP
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM28466
PNG
((2R)-3-methyl-2-({11-[(phenoxycarbonyl)amino]-8-ox...)
Show SMILES CC(C)[C@@H](NS(=O)(=O)c1ccc2oc3cc(NC(=O)Oc4ccccc4)ccc3c2c1)C(O)=O
Show InChI InChI=1S/C24H22N2O7S/c1-14(2)22(23(27)28)26-34(30,31)17-9-11-20-19(13-17)18-10-8-15(12-21(18)33-20)25-24(29)32-16-6-4-3-5-7-16/h3-14,22,26H,1-2H3,(H,25,29)(H,27,28)/t22-/m1/s1
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n/an/a 45n/an/an/an/a7.522



Wyeth Research



Assay Description
The assays for human MMP activity were performed by incubating fluorogenic peptide substrate with recombinant human MMP catalytic domain along with v...


J Med Chem 52: 1799-802 (2009)


Article DOI: 10.1021/jm900093d
BindingDB Entry DOI: 10.7270/Q2X928NP
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM28465
PNG
((2R)-3-methyl-2-[(11-{[(propan-2-yloxy)carbonyl]am...)
Show SMILES CC(C)OC(=O)Nc1ccc2c(c1)oc1ccc(cc21)S(=O)(=O)N[C@H](C(C)C)C(O)=O
Show InChI InChI=1S/C21H24N2O7S/c1-11(2)19(20(24)25)23-31(27,28)14-6-8-17-16(10-14)15-7-5-13(9-18(15)30-17)22-21(26)29-12(3)4/h5-12,19,23H,1-4H3,(H,22,26)(H,24,25)/t19-/m1/s1
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Wyeth Research



Assay Description
The assays for human MMP activity were performed by incubating fluorogenic peptide substrate with recombinant human MMP catalytic domain along with v...


J Med Chem 52: 1799-802 (2009)


Article DOI: 10.1021/jm900093d
BindingDB Entry DOI: 10.7270/Q2X928NP
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM28464
PNG
((2R)-3-methyl-2-({11-[(propoxycarbonyl)amino]-8-ox...)
Show SMILES CCCOC(=O)Nc1ccc2c(c1)oc1ccc(cc21)S(=O)(=O)N[C@H](C(C)C)C(O)=O
Show InChI InChI=1S/C21H24N2O7S/c1-4-9-29-21(26)22-13-5-7-15-16-11-14(6-8-17(16)30-18(15)10-13)31(27,28)23-19(12(2)3)20(24)25/h5-8,10-12,19,23H,4,9H2,1-3H3,(H,22,26)(H,24,25)/t19-/m1/s1
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n/an/a 14n/an/an/an/a7.522



Wyeth Research



Assay Description
The assays for human MMP activity were performed by incubating fluorogenic peptide substrate with recombinant human MMP catalytic domain along with v...


J Med Chem 52: 1799-802 (2009)


Article DOI: 10.1021/jm900093d
BindingDB Entry DOI: 10.7270/Q2X928NP
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM28463
PNG
((2R)-2-({11-[(methoxycarbonyl)amino]-8-oxatricyclo...)
Show SMILES COC(=O)Nc1ccc2c(c1)oc1ccc(cc21)S(=O)(=O)N[C@H](C(C)C)C(O)=O
Show InChI InChI=1S/C19H20N2O7S/c1-10(2)17(18(22)23)21-29(25,26)12-5-7-15-14(9-12)13-6-4-11(8-16(13)28-15)20-19(24)27-3/h4-10,17,21H,1-3H3,(H,20,24)(H,22,23)/t17-/m1/s1
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Wyeth Research



Assay Description
The assays for human MMP activity were performed by incubating fluorogenic peptide substrate with recombinant human MMP catalytic domain along with v...


J Med Chem 52: 1799-802 (2009)


Article DOI: 10.1021/jm900093d
BindingDB Entry DOI: 10.7270/Q2X928NP
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM28462
PNG
((2S)-3-methyl-2-{[12-(2,2,2-trifluoroethane-1-sulf...)
Show SMILES CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(NS(=O)(=O)CC(F)(F)F)cc21)C(O)=O
Show InChI InChI=1S/C19H19F3N2O7S2/c1-10(2)17(18(25)26)24-33(29,30)12-4-5-13-14-7-11(3-6-15(14)31-16(13)8-12)23-32(27,28)9-19(20,21)22/h3-8,10,17,23-24H,9H2,1-2H3,(H,25,26)/t17-/m0/s1
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Wyeth Research



Assay Description
The assays for human MMP activity were performed by incubating fluorogenic peptide substrate with recombinant human MMP catalytic domain along with v...


J Med Chem 52: 1799-802 (2009)


Article DOI: 10.1021/jm900093d
BindingDB Entry DOI: 10.7270/Q2X928NP
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM28461
PNG
((2S)-2-({12-methanesulfonamido-8-oxatricyclo[7.4.0...)
Show SMILES CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(NS(C)(=O)=O)cc21)C(O)=O
Show InChI InChI=1S/C18H20N2O7S2/c1-10(2)17(18(21)22)20-29(25,26)12-5-6-13-14-8-11(19-28(3,23)24)4-7-15(14)27-16(13)9-12/h4-10,17,19-20H,1-3H3,(H,21,22)/t17-/m0/s1
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n/an/a 10.3n/an/an/an/a7.522



Wyeth Research



Assay Description
The assays for human MMP activity were performed by incubating fluorogenic peptide substrate with recombinant human MMP catalytic domain along with v...


J Med Chem 52: 1799-802 (2009)


Article DOI: 10.1021/jm900093d
BindingDB Entry DOI: 10.7270/Q2X928NP
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM28460
PNG
((2R)-2-({11-benzenesulfonamido-8-oxatricyclo[7.4.0...)
Show SMILES CC(C)[C@@H](NS(=O)(=O)c1ccc2oc3cc(NS(=O)(=O)c4ccccc4)ccc3c2c1)C(O)=O
Show InChI InChI=1S/C23H22N2O7S2/c1-14(2)22(23(26)27)25-34(30,31)17-9-11-20-19(13-17)18-10-8-15(12-21(18)32-20)24-33(28,29)16-6-4-3-5-7-16/h3-14,22,24-25H,1-2H3,(H,26,27)/t22-/m1/s1
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n/an/a 100n/an/an/an/a7.522



Wyeth Research



Assay Description
The assays for human MMP activity were performed by incubating fluorogenic peptide substrate with recombinant human MMP catalytic domain along with v...


J Med Chem 52: 1799-802 (2009)


Article DOI: 10.1021/jm900093d
BindingDB Entry DOI: 10.7270/Q2X928NP
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM28459
PNG
((2R)-2-({11-[(3,5-dimethyl-1,2-oxazole-4-)sulfonam...)
Show SMILES CC(C)[C@@H](NS(=O)(=O)c1ccc2oc3cc(NS(=O)(=O)c4c(C)noc4C)ccc3c2c1)C(O)=O
Show InChI InChI=1S/C22H23N3O8S2/c1-11(2)20(22(26)27)25-34(28,29)15-6-8-18-17(10-15)16-7-5-14(9-19(16)32-18)24-35(30,31)21-12(3)23-33-13(21)4/h5-11,20,24-25H,1-4H3,(H,26,27)/t20-/m1/s1
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Wyeth Research



Assay Description
The assays for human MMP activity were performed by incubating fluorogenic peptide substrate with recombinant human MMP catalytic domain along with v...


J Med Chem 52: 1799-802 (2009)


Article DOI: 10.1021/jm900093d
BindingDB Entry DOI: 10.7270/Q2X928NP
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM28458
PNG
((2R)-3-methyl-2-{[11-(propane-2-sulfonamido)-8-oxa...)
Show SMILES CC(C)[C@@H](NS(=O)(=O)c1ccc2oc3cc(NS(=O)(=O)C(C)C)ccc3c2c1)C(O)=O
Show InChI InChI=1S/C20H24N2O7S2/c1-11(2)19(20(23)24)22-31(27,28)14-6-8-17-16(10-14)15-7-5-13(9-18(15)29-17)21-30(25,26)12(3)4/h5-12,19,21-22H,1-4H3,(H,23,24)/t19-/m1/s1
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Wyeth Research



Assay Description
The assays for human MMP activity were performed by incubating fluorogenic peptide substrate with recombinant human MMP catalytic domain along with v...


J Med Chem 52: 1799-802 (2009)


Article DOI: 10.1021/jm900093d
BindingDB Entry DOI: 10.7270/Q2X928NP
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM28457
PNG
((2S)-2-({11-methanesulfonamido-8-oxatricyclo[7.4.0...)
Show SMILES CC(C)[C@H](NS(=O)(=O)c1ccc2oc3cc(NS(C)(=O)=O)ccc3c2c1)C(O)=O
Show InChI InChI=1S/C18H20N2O7S2/c1-10(2)17(18(21)22)20-29(25,26)12-5-7-15-14(9-12)13-6-4-11(8-16(13)27-15)19-28(3,23)24/h4-10,17,19-20H,1-3H3,(H,21,22)/t17-/m0/s1
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n/an/a 170n/an/an/an/a7.522



Wyeth Research



Assay Description
The assays for human MMP activity were performed by incubating fluorogenic peptide substrate with recombinant human MMP catalytic domain along with v...


J Med Chem 52: 1799-802 (2009)


Article DOI: 10.1021/jm900093d
BindingDB Entry DOI: 10.7270/Q2X928NP
More data for this
Ligand-Target Pair
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