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Found 65 hits Enz. Inhib. hit(s) with Target = 'ADAMTS-5 (Aggrecanase-2)'   
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
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM23992
PNG
(5'-phenyl-1,2-dihydro-3'H-spiro[indole-3,2'-[1,3,4...)
Show SMILES O=C1Nc2ccccc2C11NN=C(S1)c1ccccc1
Show InChI InChI=1S/C15H11N3OS/c19-14-15(11-8-4-5-9-12(11)16-14)18-17-13(20-15)10-6-2-1-3-7-10/h1-9,18H,(H,16,19)
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PubMed
n/an/a 2.42E+4n/an/an/an/a7.530



Wyeth Research



Assay Description
ADAMTS-5 activity was determined using a fluorescence resonance energy transfer (FRET) assay using a QF peptide containing an aggrecanase cleavage si...


Bioorg Med Chem Lett 17: 5630-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.048
BindingDB Entry DOI: 10.7270/Q2H993G9
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM23994
PNG
(5-bromo-5'-phenyl-1,2-dihydro-3'H-spiro[indole-3,2...)
Show SMILES Brc1ccc2NC(=O)C3(NN=C(S3)c3ccccc3)c2c1
Show InChI InChI=1S/C15H10BrN3OS/c16-10-6-7-12-11(8-10)15(14(20)17-12)19-18-13(21-15)9-4-2-1-3-5-9/h1-8,19H,(H,17,20)
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n/an/a 1.36E+4n/an/an/an/a7.530



Wyeth Research



Assay Description
ADAMTS-5 activity was determined using a fluorescence resonance energy transfer (FRET) assay using a QF peptide containing an aggrecanase cleavage si...


Bioorg Med Chem Lett 17: 5630-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.048
BindingDB Entry DOI: 10.7270/Q2H993G9
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM23995
PNG
(5-methyl-5'-phenyl-1,2-dihydro-3'H-spiro[indole-3,...)
Show SMILES Cc1ccc2NC(=O)C3(NN=C(S3)c3ccccc3)c2c1
Show InChI InChI=1S/C16H13N3OS/c1-10-7-8-13-12(9-10)16(15(20)17-13)19-18-14(21-16)11-5-3-2-4-6-11/h2-9,19H,1H3,(H,17,20)
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n/an/a 1.11E+4n/an/an/an/a7.530



Wyeth Research



Assay Description
ADAMTS-5 activity was determined using a fluorescence resonance energy transfer (FRET) assay using a QF peptide containing an aggrecanase cleavage si...


Bioorg Med Chem Lett 17: 5630-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.048
BindingDB Entry DOI: 10.7270/Q2H993G9
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM23996
PNG
(5-ethyl-5'-phenyl-1,2-dihydro-3'H-spiro[indole-3,2...)
Show SMILES CCc1ccc2NC(=O)C3(NN=C(S3)c3ccccc3)c2c1
Show InChI InChI=1S/C17H15N3OS/c1-2-11-8-9-14-13(10-11)17(16(21)18-14)20-19-15(22-17)12-6-4-3-5-7-12/h3-10,20H,2H2,1H3,(H,18,21)
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n/an/a 9.60E+3n/an/an/an/a7.530



Wyeth Research



Assay Description
ADAMTS-5 activity was determined using a fluorescence resonance energy transfer (FRET) assay using a QF peptide containing an aggrecanase cleavage si...


Bioorg Med Chem Lett 17: 5630-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.048
BindingDB Entry DOI: 10.7270/Q2H993G9
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM23997
PNG
(5'-phenyl-5-(trifluoromethoxy)-1,2-dihydro-3'H-spi...)
Show SMILES FC(F)(F)Oc1ccc2NC(=O)C3(NN=C(S3)c3ccccc3)c2c1
Show InChI InChI=1S/C16H10F3N3O2S/c17-16(18,19)24-10-6-7-12-11(8-10)15(14(23)20-12)22-21-13(25-15)9-4-2-1-3-5-9/h1-8,22H,(H,20,23)
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n/an/a 7.20E+3n/an/an/an/a7.530



Wyeth Research



Assay Description
ADAMTS-5 activity was determined using a fluorescence resonance energy transfer (FRET) assay using a QF peptide containing an aggrecanase cleavage si...


Bioorg Med Chem Lett 17: 5630-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.048
BindingDB Entry DOI: 10.7270/Q2H993G9
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM23998
PNG
(5'-(4-methylphenyl)-1,2-dihydro-3'H-spiro[indole-3...)
Show SMILES Cc1ccc(cc1)C1=NNC2(S1)C(=O)Nc1ccccc21
Show InChI InChI=1S/C16H13N3OS/c1-10-6-8-11(9-7-10)14-18-19-16(21-14)12-4-2-3-5-13(12)17-15(16)20/h2-9,19H,1H3,(H,17,20)
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n/an/a 3.70E+3n/an/an/an/a7.530



Wyeth Research



Assay Description
ADAMTS-5 activity was determined using a fluorescence resonance energy transfer (FRET) assay using a QF peptide containing an aggrecanase cleavage si...


Bioorg Med Chem Lett 17: 5630-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.048
BindingDB Entry DOI: 10.7270/Q2H993G9
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM23999
PNG
(5-methyl-5'-(4-methylphenyl)-1,2-dihydro-3'H-spiro...)
Show SMILES Cc1ccc(cc1)C1=NNC2(S1)C(=O)Nc1ccc(C)cc21
Show InChI InChI=1S/C17H15N3OS/c1-10-3-6-12(7-4-10)15-19-20-17(22-15)13-9-11(2)5-8-14(13)18-16(17)21/h3-9,20H,1-2H3,(H,18,21)
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n/an/a 3.00E+3n/an/an/an/a7.530



Wyeth Research



Assay Description
ADAMTS-5 activity was determined using a fluorescence resonance energy transfer (FRET) assay using a QF peptide containing an aggrecanase cleavage si...


Bioorg Med Chem Lett 17: 5630-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.048
BindingDB Entry DOI: 10.7270/Q2H993G9
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM24000
PNG
(5-ethyl-5'-(4-methylphenyl)-1,2-dihydro-3'H-spiro[...)
Show SMILES CCc1ccc2NC(=O)C3(NN=C(S3)c3ccc(C)cc3)c2c1
Show InChI InChI=1S/C18H17N3OS/c1-3-12-6-9-15-14(10-12)18(17(22)19-15)21-20-16(23-18)13-7-4-11(2)5-8-13/h4-10,21H,3H2,1-2H3,(H,19,22)
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n/an/a 1.90E+3n/an/an/an/a7.530



Wyeth Research



Assay Description
ADAMTS-5 activity was determined using a fluorescence resonance energy transfer (FRET) assay using a QF peptide containing an aggrecanase cleavage si...


Bioorg Med Chem Lett 17: 5630-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.048
BindingDB Entry DOI: 10.7270/Q2H993G9
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM24001
PNG
(5'-(4-methylphenyl)-6-propyl-1,2-dihydro-3'H-spiro...)
Show SMILES CCCc1ccc2c(NC(=O)C22NN=C(S2)c2ccc(C)cc2)c1
Show InChI InChI=1S/C19H19N3OS/c1-3-4-13-7-10-15-16(11-13)20-18(23)19(15)22-21-17(24-19)14-8-5-12(2)6-9-14/h5-11,22H,3-4H2,1-2H3,(H,20,23)
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n/an/a 1.40E+3n/an/an/an/a7.530



Wyeth Research



Assay Description
ADAMTS-5 activity was determined using a fluorescence resonance energy transfer (FRET) assay using a QF peptide containing an aggrecanase cleavage si...


Bioorg Med Chem Lett 17: 5630-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.048
BindingDB Entry DOI: 10.7270/Q2H993G9
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM24002
PNG
(5'-(4-methoxyphenyl)-1,2-dihydro-3'H-spiro[indole-...)
Show SMILES COc1ccc(cc1)C1=NNC2(S1)C(=O)Nc1ccccc21
Show InChI InChI=1S/C16H13N3O2S/c1-21-11-8-6-10(7-9-11)14-18-19-16(22-14)12-4-2-3-5-13(12)17-15(16)20/h2-9,19H,1H3,(H,17,20)
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n/an/a 1.34E+4n/an/an/an/a7.530



Wyeth Research



Assay Description
ADAMTS-5 activity was determined using a fluorescence resonance energy transfer (FRET) assay using a QF peptide containing an aggrecanase cleavage si...


Bioorg Med Chem Lett 17: 5630-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.048
BindingDB Entry DOI: 10.7270/Q2H993G9
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM24003
PNG
(5'-(4-methoxyphenyl)-5-methyl-1,2-dihydro-3'H-spir...)
Show SMILES COc1ccc(cc1)C1=NNC2(S1)C(=O)Nc1ccc(C)cc21
Show InChI InChI=1S/C17H15N3O2S/c1-10-3-8-14-13(9-10)17(16(21)18-14)20-19-15(23-17)11-4-6-12(22-2)7-5-11/h3-9,20H,1-2H3,(H,18,21)
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n/an/a 2.50E+3n/an/an/an/a7.530



Wyeth Research



Assay Description
ADAMTS-5 activity was determined using a fluorescence resonance energy transfer (FRET) assay using a QF peptide containing an aggrecanase cleavage si...


Bioorg Med Chem Lett 17: 5630-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.048
BindingDB Entry DOI: 10.7270/Q2H993G9
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM24004
PNG
(5-ethyl-5'-(4-methoxyphenyl)-1,2-dihydro-3'H-spiro...)
Show SMILES CCc1ccc2NC(=O)C3(NN=C(S3)c3ccc(OC)cc3)c2c1
Show InChI InChI=1S/C18H17N3O2S/c1-3-11-4-9-15-14(10-11)18(17(22)19-15)21-20-16(24-18)12-5-7-13(23-2)8-6-12/h4-10,21H,3H2,1-2H3,(H,19,22)
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n/an/a 1.40E+3n/an/an/an/a7.530



Wyeth Research



Assay Description
ADAMTS-5 activity was determined using a fluorescence resonance energy transfer (FRET) assay using a QF peptide containing an aggrecanase cleavage si...


Bioorg Med Chem Lett 17: 5630-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.048
BindingDB Entry DOI: 10.7270/Q2H993G9
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM24005
PNG
(5-chloro-5'-(4-methoxyphenyl)-1,2-dihydro-3'H-spir...)
Show SMILES COc1ccc(cc1)C1=NNC2(S1)C(=O)Nc1ccc(Cl)cc21
Show InChI InChI=1S/C16H12ClN3O2S/c1-22-11-5-2-9(3-6-11)14-19-20-16(23-14)12-8-10(17)4-7-13(12)18-15(16)21/h2-8,20H,1H3,(H,18,21)
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n/an/a 2.00E+3n/an/an/an/a7.530



Wyeth Research



Assay Description
ADAMTS-5 activity was determined using a fluorescence resonance energy transfer (FRET) assay using a QF peptide containing an aggrecanase cleavage si...


Bioorg Med Chem Lett 17: 5630-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.048
BindingDB Entry DOI: 10.7270/Q2H993G9
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM24006
PNG
(5'-(4-methoxyphenyl)-6-propyl-1,2-dihydro-3'H-spir...)
Show SMILES CCCc1ccc2c(NC(=O)C22NN=C(S2)c2ccc(OC)cc2)c1
Show InChI InChI=1S/C19H19N3O2S/c1-3-4-12-5-10-15-16(11-12)20-18(23)19(15)22-21-17(25-19)13-6-8-14(24-2)9-7-13/h5-11,22H,3-4H2,1-2H3,(H,20,23)
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n/an/a 780n/an/an/an/a7.530



Wyeth Research



Assay Description
ADAMTS-5 activity was determined using a fluorescence resonance energy transfer (FRET) assay using a QF peptide containing an aggrecanase cleavage si...


Bioorg Med Chem Lett 17: 5630-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.048
BindingDB Entry DOI: 10.7270/Q2H993G9
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM24007
PNG
(1-benzyl-5'-(4-methoxyphenyl)-1,2-dihydro-3'H-spir...)
Show SMILES COc1ccc(cc1)C1=NNC2(S1)C(=O)N(Cc1ccccc1)c1ccccc21
Show InChI InChI=1S/C23H19N3O2S/c1-28-18-13-11-17(12-14-18)21-24-25-23(29-21)19-9-5-6-10-20(19)26(22(23)27)15-16-7-3-2-4-8-16/h2-14,25H,15H2,1H3
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n/an/a 870n/an/an/an/a7.530



Wyeth Research



Assay Description
ADAMTS-5 activity was determined using a fluorescence resonance energy transfer (FRET) assay using a QF peptide containing an aggrecanase cleavage si...


Bioorg Med Chem Lett 17: 5630-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.048
BindingDB Entry DOI: 10.7270/Q2H993G9
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM24008
PNG
(1-benzyl-5'-(4-methoxyphenyl)-5-methyl-1,2-dihydro...)
Show SMILES COc1ccc(cc1)C1=NNC2(S1)C(=O)N(Cc1ccccc1)c1ccc(C)cc21
Show InChI InChI=1S/C24H21N3O2S/c1-16-8-13-21-20(14-16)24(23(28)27(21)15-17-6-4-3-5-7-17)26-25-22(30-24)18-9-11-19(29-2)12-10-18/h3-14,26H,15H2,1-2H3
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n/an/a 640n/an/an/an/a7.530



Wyeth Research



Assay Description
ADAMTS-5 activity was determined using a fluorescence resonance energy transfer (FRET) assay using a QF peptide containing an aggrecanase cleavage si...


Bioorg Med Chem Lett 17: 5630-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.048
BindingDB Entry DOI: 10.7270/Q2H993G9
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM24009
PNG
(5'-(4-methoxyphenyl)-5-methyl-1-(2-methylphenyl)-1...)
Show SMILES COc1ccc(cc1)C1=NNC2(S1)C(=O)N(c1ccc(C)cc21)c1ccccc1C
Show InChI InChI=1S/C24H21N3O2S/c1-15-8-13-21-19(14-15)24(23(28)27(21)20-7-5-4-6-16(20)2)26-25-22(30-24)17-9-11-18(29-3)12-10-17/h4-14,26H,1-3H3
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n/an/a 900n/an/an/an/a7.530



Wyeth Research



Assay Description
ADAMTS-5 activity was determined using a fluorescence resonance energy transfer (FRET) assay using a QF peptide containing an aggrecanase cleavage si...


Bioorg Med Chem Lett 17: 5630-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.048
BindingDB Entry DOI: 10.7270/Q2H993G9
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM28306
PNG
((2R)-2-{[4-(4-chlorophenyl)benzene]sulfonamido}-3-...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)NS(=O)(=O)c1ccc(cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C21H18ClNO4S/c22-18-10-6-16(7-11-18)17-8-12-19(13-9-17)28(26,27)23-20(21(24)25)14-15-4-2-1-3-5-15/h1-13,20,23H,14H2,(H,24,25)/t20-/m1/s1
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n/an/a 3.20E+3n/an/an/an/a7.537



Japan Tobacco Inc.



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM28307
PNG
((2R)-2-{[4-(4-chlorophenyl)benzene](methyl)sulfona...)
Show SMILES CN([C@H](Cc1ccccc1)C(O)=O)S(=O)(=O)c1ccc(cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C22H20ClNO4S/c1-24(21(22(25)26)15-16-5-3-2-4-6-16)29(27,28)20-13-9-18(10-14-20)17-7-11-19(23)12-8-17/h2-14,21H,15H2,1H3,(H,25,26)/t21-/m1/s1
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n/an/a 8.00E+3n/an/an/an/a7.537



Japan Tobacco Inc.



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM28308
PNG
((2S)-2-{[4-(4-chlorophenyl)benzene](methyl)sulfona...)
Show SMILES CN([C@@H](Cc1ccccc1)C(O)=O)S(=O)(=O)c1ccc(cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C22H20ClNO4S/c1-24(21(22(25)26)15-16-5-3-2-4-6-16)29(27,28)20-13-9-18(10-14-20)17-7-11-19(23)12-8-17/h2-14,21H,15H2,1H3,(H,25,26)/t21-/m0/s1
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n/an/an/an/an/an/an/a7.537



Japan Tobacco Inc.



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM28309
PNG
((2R)-2-{[4-(4-chlorophenyl)benzene](cyclopropylmet...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)N(CC1CC1)S(=O)(=O)c1ccc(cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C25H24ClNO4S/c26-22-12-8-20(9-13-22)21-10-14-23(15-11-21)32(30,31)27(17-19-6-7-19)24(25(28)29)16-18-4-2-1-3-5-18/h1-5,8-15,19,24H,6-7,16-17H2,(H,28,29)/t24-/m1/s1
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n/an/an/an/an/an/an/a7.537



Japan Tobacco Inc.



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM28310
PNG
((2R)-2-{[4-(4-chlorophenyl)benzene](cyclohexylmeth...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)N(CC1CCCCC1)S(=O)(=O)c1ccc(cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C28H30ClNO4S/c29-25-15-11-23(12-16-25)24-13-17-26(18-14-24)35(33,34)30(20-22-9-5-2-6-10-22)27(28(31)32)19-21-7-3-1-4-8-21/h1,3-4,7-8,11-18,22,27H,2,5-6,9-10,19-20H2,(H,31,32)/t27-/m1/s1
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n/an/an/an/an/an/an/a7.537



Japan Tobacco Inc.



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM28311
PNG
((2R)-2-{benzyl[4-(4-chlorophenyl)benzene]sulfonami...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)N(Cc1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C28H24ClNO4S/c29-25-15-11-23(12-16-25)24-13-17-26(18-14-24)35(33,34)30(20-22-9-5-2-6-10-22)27(28(31)32)19-21-7-3-1-4-8-21/h1-18,27H,19-20H2,(H,31,32)/t27-/m1/s1
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n/an/an/an/an/an/an/a7.537



Japan Tobacco Inc.



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM28312
PNG
((2R)-2-{[4-(4-chlorophenyl)benzene](2-phenylethyl)...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)N(CCc1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C29H26ClNO4S/c30-26-15-11-24(12-16-26)25-13-17-27(18-14-25)36(34,35)31(20-19-22-7-3-1-4-8-22)28(29(32)33)21-23-9-5-2-6-10-23/h1-18,28H,19-21H2,(H,32,33)/t28-/m1/s1
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n/an/a 7.30E+3n/an/an/an/a7.537



Japan Tobacco Inc.



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM28313
PNG
((2R)-2-{[4-(4-chlorophenyl)benzene][2-(2-oxopyrrol...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)N(CCN1CCCC1=O)S(=O)(=O)c1ccc(cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C27H27ClN2O5S/c28-23-12-8-21(9-13-23)22-10-14-24(15-11-22)36(34,35)30(18-17-29-16-4-7-26(29)31)25(27(32)33)19-20-5-2-1-3-6-20/h1-3,5-6,8-15,25H,4,7,16-19H2,(H,32,33)/t25-/m1/s1
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n/an/a 1.60E+3n/an/an/an/a7.537



Japan Tobacco Inc.



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM28314
PNG
((1R,2S)-1-{[4-(4-chlorophenyl)benzene][2-(2-oxopyr...)
Show SMILES OC(=O)[C@]1(C[C@H]1c1ccccc1)N(CCN1CCCC1=O)S(=O)(=O)c1ccc(cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C28H27ClN2O5S/c29-23-12-8-20(9-13-23)21-10-14-24(15-11-21)37(35,36)31(18-17-30-16-4-7-26(30)32)28(27(33)34)19-25(28)22-5-2-1-3-6-22/h1-3,5-6,8-15,25H,4,7,16-19H2,(H,33,34)/t25-,28+/m0/s1
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n/an/a 200n/an/an/an/a7.537



Japan Tobacco Inc.



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM28315
PNG
((2R)-2-{[4-(4-chlorophenyl)benzene][2-(2-oxopyrrol...)
Show SMILES C[C@](Cc1ccccc1)(N(CCN1CCCC1=O)S(=O)(=O)c1ccc(cc1)-c1ccc(Cl)cc1)C(O)=O
Show InChI InChI=1S/C28H29ClN2O5S/c1-28(27(33)34,20-21-6-3-2-4-7-21)31(19-18-30-17-5-8-26(30)32)37(35,36)25-15-11-23(12-16-25)22-9-13-24(29)14-10-22/h2-4,6-7,9-16H,5,8,17-20H2,1H3,(H,33,34)/t28-/m1/s1
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n/an/an/an/an/an/an/a7.537



Japan Tobacco Inc.



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM28316
PNG
((1R,2S)-1-({[4-(4-chlorophenyl)-1,2,3,6-tetrahydro...)
Show SMILES OC(=O)[C@]1(C[C@H]1c1ccccc1)N(CCN1CCCC1=O)S(=O)(=O)N1CCC(=CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C27H30ClN3O5S/c28-23-10-8-20(9-11-23)21-12-15-30(16-13-21)37(35,36)31(18-17-29-14-4-7-25(29)32)27(26(33)34)19-24(27)22-5-2-1-3-6-22/h1-3,5-6,8-12,24H,4,7,13-19H2,(H,33,34)/t24-,27+/m0/s1
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n/an/a 880n/an/an/an/a7.537



Japan Tobacco Inc.



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM28317
PNG
((1R,2S)-1-{[6-(4-chlorophenyl)pyridine-3-][2-(2-ox...)
Show SMILES OC(=O)[C@]1(C[C@H]1c1ccccc1)N(CCN1CCCC1=O)S(=O)(=O)c1ccc(nc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C27H26ClN3O5S/c28-21-10-8-20(9-11-21)24-13-12-22(18-29-24)37(35,36)31(16-15-30-14-4-7-25(30)32)27(26(33)34)17-23(27)19-5-2-1-3-6-19/h1-3,5-6,8-13,18,23H,4,7,14-17H2,(H,33,34)/t23-,27+/m0/s1
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n/an/a 1.10E+3n/an/an/an/a7.537



Japan Tobacco Inc.



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM28318
PNG
((1R,2S)-1-({4-[4-(dimethylamino)phenyl]benzene}[2-...)
Show SMILES CN(C)c1ccc(cc1)-c1ccc(cc1)S(=O)(=O)N(CCN1CCCC1=O)[C@@]1(C[C@H]1c1ccccc1)C(O)=O
Show InChI InChI=1S/C30H33N3O5S/c1-31(2)25-14-10-22(11-15-25)23-12-16-26(17-13-23)39(37,38)33(20-19-32-18-6-9-28(32)34)30(29(35)36)21-27(30)24-7-4-3-5-8-24/h3-5,7-8,10-17,27H,6,9,18-21H2,1-2H3,(H,35,36)/t27-,30+/m0/s1
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n/an/a 6.60E+3n/an/an/an/a7.537



Japan Tobacco Inc.



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM28319
PNG
((1R,2S)-1-{[4-(4-acetamidophenyl)benzene][2-(2-oxo...)
Show SMILES CC(=O)Nc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)N(CCN1CCCC1=O)[C@@]1(C[C@H]1c1ccccc1)C(O)=O
Show InChI InChI=1S/C30H31N3O6S/c1-21(34)31-25-13-9-22(10-14-25)23-11-15-26(16-12-23)40(38,39)33(19-18-32-17-5-8-28(32)35)30(29(36)37)20-27(30)24-6-3-2-4-7-24/h2-4,6-7,9-16,27H,5,8,17-20H2,1H3,(H,31,34)(H,36,37)/t27-,30+/m0/s1
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n/an/a 4.50E+3n/an/an/an/a7.537



Japan Tobacco Inc.



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM28320
PNG
((1R,2S)-1-{[2-(2-oxopyrrolidin-1-yl)ethyl][4-(pyri...)
Show SMILES OC(=O)[C@]1(C[C@H]1c1ccccc1)N(CCN1CCCC1=O)S(=O)(=O)c1ccc(cc1)-c1ccncc1
Show InChI InChI=1S/C27H27N3O5S/c31-25-7-4-16-29(25)17-18-30(27(26(32)33)19-24(27)22-5-2-1-3-6-22)36(34,35)23-10-8-20(9-11-23)21-12-14-28-15-13-21/h1-3,5-6,8-15,24H,4,7,16-19H2,(H,32,33)/t24-,27+/m0/s1
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n/an/an/an/an/an/an/a7.537



Japan Tobacco Inc.



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM28322
PNG
((1R,2S)-1-{[4-(3-methoxyprop-1-yn-1-yl)benzene][2-...)
Show SMILES COCC#Cc1ccc(cc1)S(=O)(=O)N(CCN1CCCC1=O)[C@@]1(C[C@H]1c1ccccc1)C(O)=O
Show InChI InChI=1S/C26H28N2O6S/c1-34-18-6-7-20-11-13-22(14-12-20)35(32,33)28(17-16-27-15-5-10-24(27)29)26(25(30)31)19-23(26)21-8-3-2-4-9-21/h2-4,8-9,11-14,23H,5,10,15-19H2,1H3,(H,30,31)/t23-,26+/m0/s1
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n/an/an/an/an/an/an/a7.537



Japan Tobacco Inc.



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM28323
PNG
((1R,2S)-1-{[4-(4-chlorophenyl)benzene][2-(2,5-diox...)
Show SMILES OC(=O)[C@]1(C[C@H]1c1ccccc1)N(CCN1C(=O)CCC1=O)S(=O)(=O)c1ccc(cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C28H25ClN2O6S/c29-22-10-6-19(7-11-22)20-8-12-23(13-9-20)38(36,37)31(17-16-30-25(32)14-15-26(30)33)28(27(34)35)18-24(28)21-4-2-1-3-5-21/h1-13,24H,14-18H2,(H,34,35)/t24-,28+/m0/s1
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n/an/a 310n/an/an/an/a7.537



Japan Tobacco Inc.



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM28324
PNG
((1R,2S)-1-{[4-(4-chlorophenyl)benzene][2-(2-oxo-1,...)
Show SMILES OC(=O)[C@]1(C[C@H]1c1ccccc1)N(CCN1CCOC1=O)S(=O)(=O)c1ccc(cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C27H25ClN2O6S/c28-22-10-6-19(7-11-22)20-8-12-23(13-9-20)37(34,35)30(15-14-29-16-17-36-26(29)33)27(25(31)32)18-24(27)21-4-2-1-3-5-21/h1-13,24H,14-18H2,(H,31,32)/t24-,27+/m0/s1
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n/an/a 220n/an/an/an/a7.537



Japan Tobacco Inc.



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM28325
PNG
((1R,2S)-1-{[4-(4-chlorophenyl)benzene][2-(2-oxopip...)
Show SMILES OC(=O)[C@]1(C[C@H]1c1ccccc1)N(CCN1CCCCC1=O)S(=O)(=O)c1ccc(cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C29H29ClN2O5S/c30-24-13-9-21(10-14-24)22-11-15-25(16-12-22)38(36,37)32(19-18-31-17-5-4-8-27(31)33)29(28(34)35)20-26(29)23-6-2-1-3-7-23/h1-3,6-7,9-16,26H,4-5,8,17-20H2,(H,34,35)/t26-,29+/m0/s1
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n/an/a 210n/an/an/an/a7.537



Japan Tobacco Inc.



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM28326
PNG
((1R,2S)-1-{[4-(4-chlorophenyl)benzene][2-(2-oxo-1,...)
Show SMILES OC(=O)[C@]1(C[C@H]1c1ccccc1)N(CCN1CCCOC1=O)S(=O)(=O)c1ccc(cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C28H27ClN2O6S/c29-23-11-7-20(8-12-23)21-9-13-24(14-10-21)38(35,36)31(17-16-30-15-4-18-37-27(30)34)28(26(32)33)19-25(28)22-5-2-1-3-6-22/h1-3,5-14,25H,4,15-19H2,(H,32,33)/t25-,28+/m0/s1
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n/an/a 180n/an/an/an/a7.537



Japan Tobacco Inc.



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM28327
PNG
((1R,2S)-1-{[4-(4-chlorophenyl)benzene][2-(3-methox...)
Show SMILES COc1cccn(CCN([C@@]2(C[C@H]2c2ccccc2)C(O)=O)S(=O)(=O)c2ccc(cc2)-c2ccc(Cl)cc2)c1=O
Show InChI InChI=1S/C30H27ClN2O6S/c1-39-27-8-5-17-32(28(27)34)18-19-33(30(29(35)36)20-26(30)23-6-3-2-4-7-23)40(37,38)25-15-11-22(12-16-25)21-9-13-24(31)14-10-21/h2-17,26H,18-20H2,1H3,(H,35,36)/t26-,30+/m0/s1
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n/an/a 78n/an/an/an/a7.537



Japan Tobacco Inc.



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM28328
PNG
((1R,2S)-1-{[4-(4-chlorophenyl)benzene][2-(pyridin-...)
Show SMILES OC(=O)[C@]1(C[C@H]1c1ccccc1)N(CCc1ccncc1)S(=O)(=O)c1ccc(cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C29H25ClN2O4S/c30-25-10-6-22(7-11-25)23-8-12-26(13-9-23)37(35,36)32(19-16-21-14-17-31-18-15-21)29(28(33)34)20-27(29)24-4-2-1-3-5-24/h1-15,17-18,27H,16,19-20H2,(H,33,34)/t27-,29+/m0/s1
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n/an/a 750n/an/an/an/a7.537



Japan Tobacco Inc.



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM28321
PNG
((1R,2S)-1-{[4-(3-hydroxyprop-1-yn-1-yl)benzene][2-...)
Show SMILES OCC#Cc1ccc(cc1)S(=O)(=O)N(CCN1CCCC1=O)[C@@]1(C[C@H]1c1ccccc1)C(O)=O
Show InChI InChI=1S/C25H26N2O6S/c28-17-5-6-19-10-12-21(13-11-19)34(32,33)27(16-15-26-14-4-9-23(26)29)25(24(30)31)18-22(25)20-7-2-1-3-8-20/h1-3,7-8,10-13,22,28H,4,9,14-18H2,(H,30,31)/t22-,25+/m0/s1
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n/an/an/an/an/an/an/a7.537



Japan Tobacco Inc.



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM24010
PNG
(5-bromo-5'-(4-methoxyphenyl)-1,2-dihydro-3'H-spiro...)
Show SMILES COc1ccc(cc1)C1=NNC2(S1)C(=O)Nc1ccc(Br)cc21
Show InChI InChI=1S/C16H12BrN3O2S/c1-22-11-5-2-9(3-6-11)14-19-20-16(23-14)12-8-10(17)4-7-13(12)18-15(16)21/h2-8,20H,1H3,(H,18,21)
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n/an/a 2.40E+3n/an/an/an/an/an/a



Wyeth Research



Assay Description
ADAMTS-5 activity was determined using a fluorescence resonance energy transfer (FRET) assay using a QF peptide containing an aggrecanase cleavage si...


Bioorg Med Chem Lett 17: 5630-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.048
BindingDB Entry DOI: 10.7270/Q2H993G9
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM28340
PNG
((1R,2S)-1-{[4-(4-chlorophenyl)benzene][2-(9H-purin...)
Show SMILES OC(=O)[C@]1(C[C@H]1c1ccccc1)N(CCn1cnc2cncnc12)S(=O)(=O)c1ccc(cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C29H24ClN5O4S/c30-23-10-6-20(7-11-23)21-8-12-24(13-9-21)40(38,39)35(15-14-34-19-33-26-17-31-18-32-27(26)34)29(28(36)37)16-25(29)22-4-2-1-3-5-22/h1-13,17-19,25H,14-16H2,(H,36,37)/t25-,29+/m0/s1
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n/an/a 170n/an/an/an/an/an/a



Japan Tobacco Inc.



Assay Description
The ADAMTS-5 (Aggrecanase-2) assay was performed using fluorescent peptide substrate WAAG-3R and the recombinant Agg-2 pre-incubated with various con...


Bioorg Med Chem Lett 19: 1575-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.024
BindingDB Entry DOI: 10.7270/Q2PV6HPW
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM24012
PNG
(5'-(4-methoxyphenyl)-6-methyl-1,2-dihydro-3'H-spir...)
Show SMILES COc1ccc(cc1)C1=NNC2(S1)C(=O)Nc1cc(C)ccc21
Show InChI InChI=1S/C17H15N3O2S/c1-10-3-8-13-14(9-10)18-16(21)17(13)20-19-15(23-17)11-4-6-12(22-2)7-5-11/h3-9,20H,1-2H3,(H,18,21)
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n/an/a 1.40E+3n/an/an/an/an/an/a



Wyeth Research



Assay Description
ADAMTS-5 activity was determined using a fluorescence resonance energy transfer (FRET) assay using a QF peptide containing an aggrecanase cleavage si...


Bioorg Med Chem Lett 17: 5630-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.048
BindingDB Entry DOI: 10.7270/Q2H993G9
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM24013
PNG
(6-chloro-5'-(4-methoxyphenyl)-1,2-dihydro-3'H-spir...)
Show SMILES COc1ccc(cc1)C1=NNC2(S1)C(=O)Nc1cc(Cl)ccc21
Show InChI InChI=1S/C16H12ClN3O2S/c1-22-11-5-2-9(3-6-11)14-19-20-16(23-14)12-7-4-10(17)8-13(12)18-15(16)21/h2-8,20H,1H3,(H,18,21)
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n/an/a 1.20E+3n/an/an/an/an/an/a



Wyeth Research



Assay Description
ADAMTS-5 activity was determined using a fluorescence resonance energy transfer (FRET) assay using a QF peptide containing an aggrecanase cleavage si...


Bioorg Med Chem Lett 17: 5630-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.048
BindingDB Entry DOI: 10.7270/Q2H993G9
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM24014
PNG
(1-methyl-5'-phenyl-1,2-dihydro-3'H-spiro[indole-3,...)
Show SMILES CN1C(=O)C2(NN=C(S2)c2ccccc2)c2ccccc12
Show InChI InChI=1S/C16H13N3OS/c1-19-13-10-6-5-9-12(13)16(15(19)20)18-17-14(21-16)11-7-3-2-4-8-11/h2-10,18H,1H3
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n/an/a 2.41E+4n/an/an/an/an/an/a



Wyeth Research



Assay Description
ADAMTS-5 activity was determined using a fluorescence resonance energy transfer (FRET) assay using a QF peptide containing an aggrecanase cleavage si...


Bioorg Med Chem Lett 17: 5630-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.048
BindingDB Entry DOI: 10.7270/Q2H993G9
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM24015
PNG
(5'-phenyl-1-(propan-2-yl)-1,2-dihydro-3'H-spiro[in...)
Show SMILES CC(C)N1C(=O)C2(NN=C(S2)c2ccccc2)c2ccccc12
Show InChI InChI=1S/C18H17N3OS/c1-12(2)21-15-11-7-6-10-14(15)18(17(21)22)20-19-16(23-18)13-8-4-3-5-9-13/h3-12,20H,1-2H3
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n/an/a 3.10E+3n/an/an/an/an/an/a



Wyeth Research



Assay Description
ADAMTS-5 activity was determined using a fluorescence resonance energy transfer (FRET) assay using a QF peptide containing an aggrecanase cleavage si...


Bioorg Med Chem Lett 17: 5630-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.048
BindingDB Entry DOI: 10.7270/Q2H993G9
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM24016
PNG
(1,5'-diphenyl-1,2-dihydro-3'H-spiro[indole-3,2'-[1...)
Show SMILES O=C1N(c2ccccc2C11NN=C(S1)c1ccccc1)c1ccccc1
Show InChI InChI=1S/C21H15N3OS/c25-20-21(23-22-19(26-21)15-9-3-1-4-10-15)17-13-7-8-14-18(17)24(20)16-11-5-2-6-12-16/h1-14,23H
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n/an/a 2.60E+3n/an/an/an/an/an/a



Wyeth Research



Assay Description
ADAMTS-5 activity was determined using a fluorescence resonance energy transfer (FRET) assay using a QF peptide containing an aggrecanase cleavage si...


Bioorg Med Chem Lett 17: 5630-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.048
BindingDB Entry DOI: 10.7270/Q2H993G9
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM24017
PNG
(1-methyl-5'-(4-methylphenyl)-1,2-dihydro-3'H-spiro...)
Show SMILES CN1C(=O)C2(NN=C(S2)c2ccc(C)cc2)c2ccccc12
Show InChI InChI=1S/C17H15N3OS/c1-11-7-9-12(10-8-11)15-18-19-17(22-15)13-5-3-4-6-14(13)20(2)16(17)21/h3-10,19H,1-2H3
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n/an/a 4.60E+3n/an/an/an/an/an/a



Wyeth Research



Assay Description
ADAMTS-5 activity was determined using a fluorescence resonance energy transfer (FRET) assay using a QF peptide containing an aggrecanase cleavage si...


Bioorg Med Chem Lett 17: 5630-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.048
BindingDB Entry DOI: 10.7270/Q2H993G9
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM24018
PNG
(5-methyl-1-(2-methylphenyl)-5'-(4-methylphenyl)-1,...)
Show SMILES Cc1ccc(cc1)C1=NNC2(S1)C(=O)N(c1ccc(C)cc21)c1ccccc1C
Show InChI InChI=1S/C24H21N3OS/c1-15-8-11-18(12-9-15)22-25-26-24(29-22)19-14-16(2)10-13-21(19)27(23(24)28)20-7-5-4-6-17(20)3/h4-14,26H,1-3H3
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n/an/a 1.20E+3n/an/an/an/an/an/a



Wyeth Research



Assay Description
ADAMTS-5 activity was determined using a fluorescence resonance energy transfer (FRET) assay using a QF peptide containing an aggrecanase cleavage si...


Bioorg Med Chem Lett 17: 5630-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.048
BindingDB Entry DOI: 10.7270/Q2H993G9
More data for this
Ligand-Target Pair
ADAMTS-5 (Aggrecanase-2)


(Homo sapiens (human))
BDBM24019
PNG
(1-benzyl-5-methyl-5'-(4-methylphenyl)-1,2-dihydro-...)
Show SMILES Cc1ccc(cc1)C1=NNC2(S1)C(=O)N(Cc1ccccc1)c1ccc(C)cc21
Show InChI InChI=1S/C24H21N3OS/c1-16-8-11-19(12-9-16)22-25-26-24(29-22)20-14-17(2)10-13-21(20)27(23(24)28)15-18-6-4-3-5-7-18/h3-14,26H,15H2,1-2H3
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n/an/a 610n/an/an/an/an/an/a



Wyeth Research



Assay Description
ADAMTS-5 activity was determined using a fluorescence resonance energy transfer (FRET) assay using a QF peptide containing an aggrecanase cleavage si...


Bioorg Med Chem Lett 17: 5630-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.048
BindingDB Entry DOI: 10.7270/Q2H993G9
More data for this
Ligand-Target Pair
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