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PubMed code 19515558

Compile data set for download or QSAR
Found 120 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
Procathepsin L [114-333,T223A]


(Homo sapiens (Human))		BDBM31993
PNG
(Dipeptidyl nitrile inhibitor, 26)
Show SMILES Cc1cccc(C[C@H](NC(=O)c2cc(nn2C)C(C)(C)C)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C21H27N5O2/c1-14-7-6-8-15(11-14)12-16(19(27)23-10-9-22)24-20(28)17-13-18(21(2,3)4)25-26(17)5/h6-8,11,13,16H,10,12H2,1-5H3,(H,23,27)(H,24,28)/t16-/m0/s1
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n/an/a 13n/an/an/an/a7.037



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Procathepsin L [114-333,T223A]


(Homo sapiens (Human))		BDBM31992
PNG
(Dipeptidyl nitrile inhibitor, 25)
Show SMILES Cn1nc(cc1C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N)C(C)(C)C |r|
Show InChI InChI=1S/C20H24ClN5O2/c1-20(2,3)17-12-16(26(4)25-17)19(28)24-15(18(27)23-9-8-22)11-13-6-5-7-14(21)10-13/h5-7,10,12,15H,9,11H2,1-4H3,(H,23,27)(H,24,28)/t15-/m0/s1
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n/an/a 13n/an/an/an/a7.037



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Procathepsin L [114-333,T223A]


(Homo sapiens (Human))		BDBM31984
PNG
(Dipeptidyl nitrile inhibitor, 17)
Show SMILES Cc1ccc2cc(C)cc(C(=O)N[C@@H](Cc3cccc(Cl)c3)C(=O)NCC#N)c2c1 |r|
Show InChI InChI=1S/C24H22ClN3O2/c1-15-6-7-18-10-16(2)12-21(20(18)11-15)23(29)28-22(24(30)27-9-8-26)14-17-4-3-5-19(25)13-17/h3-7,10-13,22H,9,14H2,1-2H3,(H,27,30)(H,28,29)/t22-/m0/s1
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n/an/a 20n/an/an/an/a7.037



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Procathepsin L [114-333,T223A]


(Homo sapiens (Human))		BDBM31980
PNG
(Dipeptidyl nitrile inhibitor, 13)
Show SMILES Cc1cc(C)cc(c1)C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C20H20ClN3O2/c1-13-8-14(2)10-16(9-13)19(25)24-18(20(26)23-7-6-22)12-15-4-3-5-17(21)11-15/h3-5,8-11,18H,7,12H2,1-2H3,(H,23,26)(H,24,25)/t18-/m0/s1
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Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Procathepsin L [114-333,T223A]


(Homo sapiens (Human))		BDBM31990
PNG
(Dipeptidyl nitrile inhibitor, 23)
Show SMILES CCc1cc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)n(C)n1 |r|
Show InChI InChI=1S/C18H20ClN5O2/c1-3-14-11-16(24(2)23-14)18(26)22-15(17(25)21-8-7-20)10-12-5-4-6-13(19)9-12/h4-6,9,11,15H,3,8,10H2,1-2H3,(H,21,25)(H,22,26)/t15-/m0/s1
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Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Procathepsin L [114-333,T223A]


(Homo sapiens (Human))		BDBM31977
PNG
(Dipeptidyl nitrile inhibitor, 10)
Show SMILES Clc1cccc(C[C@H](NC(=O)c2cccc(Cl)c2)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C18H15Cl2N3O2/c19-14-5-1-3-12(9-14)10-16(18(25)22-8-7-21)23-17(24)13-4-2-6-15(20)11-13/h1-6,9,11,16H,8,10H2,(H,22,25)(H,23,24)/t16-/m0/s1
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AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Procathepsin L [114-333,T223A]


(Homo sapiens (Human))		BDBM31978
PNG
(Dipeptidyl nitrile inhibitor, 11)
Show SMILES Cc1ccc(C)c(c1)C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C20H20ClN3O2/c1-13-6-7-14(2)17(10-13)19(25)24-18(20(26)23-9-8-22)12-15-4-3-5-16(21)11-15/h3-7,10-11,18H,9,12H2,1-2H3,(H,23,26)(H,24,25)/t18-/m0/s1
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Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Procathepsin L [114-333,T223A]


(Homo sapiens (Human))		BDBM31991
PNG
(Dipeptidyl nitrile inhibitor, 24)
Show SMILES CC(C)c1cc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)n(C)n1 |r|
Show InChI InChI=1S/C19H22ClN5O2/c1-12(2)15-11-17(25(3)24-15)19(27)23-16(18(26)22-8-7-21)10-13-5-4-6-14(20)9-13/h4-6,9,11-12,16H,8,10H2,1-3H3,(H,22,26)(H,23,27)/t16-/m0/s1
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Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Procathepsin L [114-333,T223A]


(Homo sapiens (Human))		BDBM31989
PNG
(Dipeptidyl nitrile inhibitor, 22)
Show SMILES Cc1cc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)c(C)s1 |r|
Show InChI InChI=1S/C18H18ClN3O2S/c1-11-8-15(12(2)25-11)17(23)22-16(18(24)21-7-6-20)10-13-4-3-5-14(19)9-13/h3-5,8-9,16H,7,10H2,1-2H3,(H,21,24)(H,22,23)/t16-/m0/s1
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AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Procathepsin L [114-333,T223A]


(Homo sapiens (Human))		BDBM31983
PNG
(Dipeptidyl nitrile inhibitor, 16)
Show SMILES Clc1cccc(C[C@H](NC(=O)c2ccnc3ccccc23)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C21H17ClN4O2/c22-15-5-3-4-14(12-15)13-19(21(28)25-11-9-23)26-20(27)17-8-10-24-18-7-2-1-6-16(17)18/h1-8,10,12,19H,11,13H2,(H,25,28)(H,26,27)/t19-/m0/s1
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n/an/a 100n/an/an/an/a7.037



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))		BDBM31970
PNG
(Dipeptidyl nitrile inhibitor, 1)
Show SMILES Clc1cccc(C[C@H](NC(=O)c2ccccc2)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C18H16ClN3O2/c19-15-8-4-5-13(11-15)12-16(18(24)21-10-9-20)22-17(23)14-6-2-1-3-7-14/h1-8,11,16H,10,12H2,(H,21,24)(H,22,23)/t16-/m0/s1
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Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin L2


(Homo sapiens (Human))		BDBM31977
PNG
(Dipeptidyl nitrile inhibitor, 10)
Show SMILES Clc1cccc(C[C@H](NC(=O)c2cccc(Cl)c2)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C18H15Cl2N3O2/c19-14-5-1-3-12(9-14)10-16(18(25)22-8-7-21)23-17(24)13-4-2-6-15(20)11-13/h1-6,9,11,16H,8,10H2,(H,22,25)(H,23,24)/t16-/m0/s1
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Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))		BDBM31977
PNG
(Dipeptidyl nitrile inhibitor, 10)
Show SMILES Clc1cccc(C[C@H](NC(=O)c2cccc(Cl)c2)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C18H15Cl2N3O2/c19-14-5-1-3-12(9-14)10-16(18(25)22-8-7-21)23-17(24)13-4-2-6-15(20)11-13/h1-6,9,11,16H,8,10H2,(H,22,25)(H,23,24)/t16-/m0/s1
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Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))		BDBM31988
PNG
(Dipeptidyl nitrile inhibitor, 21)
Show SMILES Cc1nc(C)c(s1)C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C17H17ClN4O2S/c1-10-15(25-11(2)21-10)17(24)22-14(16(23)20-7-6-19)9-12-4-3-5-13(18)8-12/h3-5,8,14H,7,9H2,1-2H3,(H,20,23)(H,22,24)/t14-/m0/s1
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Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin L2


(Homo sapiens (Human))		BDBM31992
PNG
(Dipeptidyl nitrile inhibitor, 25)
Show SMILES Cn1nc(cc1C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N)C(C)(C)C |r|
Show InChI InChI=1S/C20H24ClN5O2/c1-20(2,3)17-12-16(26(4)25-17)19(28)24-15(18(27)23-9-8-22)11-13-6-5-7-14(21)10-13/h5-7,10,12,15H,9,11H2,1-4H3,(H,23,27)(H,24,28)/t15-/m0/s1
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Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin L2


(Homo sapiens (Human))		BDBM31980
PNG
(Dipeptidyl nitrile inhibitor, 13)
Show SMILES Cc1cc(C)cc(c1)C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C20H20ClN3O2/c1-13-8-14(2)10-16(9-13)19(25)24-18(20(26)23-7-6-22)12-15-4-3-5-17(21)11-15/h3-5,8-11,18H,7,12H2,1-2H3,(H,23,26)(H,24,25)/t18-/m0/s1
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Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Procathepsin L [114-333,T223A]


(Homo sapiens (Human))		BDBM31974
PNG
(Dipeptidyl nitrile inhibitor, 7)
Show SMILES Cc1ccc(cc1)C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C19H18ClN3O2/c1-13-5-7-15(8-6-13)18(24)23-17(19(25)22-10-9-21)12-14-3-2-4-16(20)11-14/h2-8,11,17H,10,12H2,1H3,(H,22,25)(H,23,24)/t17-/m0/s1
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Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin L2


(Homo sapiens (Human))		BDBM31988
PNG
(Dipeptidyl nitrile inhibitor, 21)
Show SMILES Cc1nc(C)c(s1)C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C17H17ClN4O2S/c1-10-15(25-11(2)21-10)17(24)22-14(16(23)20-7-6-19)9-12-4-3-5-13(18)8-12/h3-5,8,14H,7,9H2,1-2H3,(H,20,23)(H,22,24)/t14-/m0/s1
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AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Procathepsin L [114-333,T223A]


(Homo sapiens (Human))		BDBM31970
PNG
(Dipeptidyl nitrile inhibitor, 1)
Show SMILES Clc1cccc(C[C@H](NC(=O)c2ccccc2)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C18H16ClN3O2/c19-15-8-4-5-13(11-15)12-16(18(24)21-10-9-20)22-17(23)14-6-2-1-3-7-14/h1-8,11,16H,10,12H2,(H,21,24)(H,22,23)/t16-/m0/s1
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Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Procathepsin L [114-333,T223A]


(Homo sapiens (Human))		BDBM31981
PNG
(Dipeptidyl nitrile inhibitor, 14)
Show SMILES Clc1cccc(C[C@H](NC(=O)c2cccc3ccccc23)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C22H18ClN3O2/c23-17-8-3-5-15(13-17)14-20(22(28)25-12-11-24)26-21(27)19-10-4-7-16-6-1-2-9-18(16)19/h1-10,13,20H,12,14H2,(H,25,28)(H,26,27)/t20-/m0/s1
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n/an/a 251n/an/an/an/a7.037



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Procathepsin L [114-333,T223A]


(Homo sapiens (Human))		BDBM31975
PNG
(Dipeptidyl nitrile inhibitor, 8)
Show SMILES Cc1cccc(c1)C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C19H18ClN3O2/c1-13-4-2-6-15(10-13)18(24)23-17(19(25)22-9-8-21)12-14-5-3-7-16(20)11-14/h2-7,10-11,17H,9,12H2,1H3,(H,22,25)(H,23,24)/t17-/m0/s1
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n/an/a 251n/an/an/an/a7.037



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Procathepsin L [114-333,T223A]


(Homo sapiens (Human))		BDBM31979
PNG
(Dipeptidyl nitrile inhibitor, 12)
Show SMILES Cc1cccc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)c1C |r|
Show InChI InChI=1S/C20H20ClN3O2/c1-13-5-3-8-17(14(13)2)19(25)24-18(20(26)23-10-9-22)12-15-6-4-7-16(21)11-15/h3-8,11,18H,10,12H2,1-2H3,(H,23,26)(H,24,25)/t18-/m0/s1
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n/an/a 316n/an/an/an/a7.037



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Procathepsin L [114-333,T223A]


(Homo sapiens (Human))		BDBM31973
PNG
(Dipeptidyl nitrile inhibitor, 6)
Show SMILES Clc1cccc(C[C@H](NC(=O)C2CCCCCC2)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C19H24ClN3O2/c20-16-9-5-6-14(12-16)13-17(19(25)22-11-10-21)23-18(24)15-7-3-1-2-4-8-15/h5-6,9,12,15,17H,1-4,7-8,11,13H2,(H,22,25)(H,23,24)/t17-/m0/s1
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n/an/a 316n/an/an/an/a7.037



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))		BDBM31980
PNG
(Dipeptidyl nitrile inhibitor, 13)
Show SMILES Cc1cc(C)cc(c1)C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C20H20ClN3O2/c1-13-8-14(2)10-16(9-13)19(25)24-18(20(26)23-7-6-22)12-15-4-3-5-17(21)11-15/h3-5,8-11,18H,7,12H2,1-2H3,(H,23,26)(H,24,25)/t18-/m0/s1
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AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin L2


(Homo sapiens (Human))		BDBM31972
PNG
(Dipeptidyl nitrile inhibitor, 5)
Show SMILES Clc1cccc(C[C@H](NC(=O)C2=CCCCC2)C(=O)NCC#N)c1 |r,t:11|
Show InChI InChI=1S/C18H20ClN3O2/c19-15-8-4-5-13(11-15)12-16(18(24)21-10-9-20)22-17(23)14-6-2-1-3-7-14/h4-6,8,11,16H,1-3,7,10,12H2,(H,21,24)(H,22,23)/t16-/m0/s1
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AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin L2


(Homo sapiens (Human))		BDBM31993
PNG
(Dipeptidyl nitrile inhibitor, 26)
Show SMILES Cc1cccc(C[C@H](NC(=O)c2cc(nn2C)C(C)(C)C)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C21H27N5O2/c1-14-7-6-8-15(11-14)12-16(19(27)23-10-9-22)24-20(28)17-13-18(21(2,3)4)25-26(17)5/h6-8,11,13,16H,10,12H2,1-5H3,(H,23,27)(H,24,28)/t16-/m0/s1
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AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))		BDBM31975
PNG
(Dipeptidyl nitrile inhibitor, 8)
Show SMILES Cc1cccc(c1)C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C19H18ClN3O2/c1-13-4-2-6-15(10-13)18(24)23-17(19(25)22-9-8-21)12-14-5-3-7-16(20)11-14/h2-7,10-11,17H,9,12H2,1H3,(H,22,25)(H,23,24)/t17-/m0/s1
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n/an/a 398n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Procathepsin L [114-333,T223A]


(Homo sapiens (Human))		BDBM31982
PNG
(Dipeptidyl nitrile inhibitor, 15)
Show SMILES Clc1cccc(C[C@H](NC(=O)c2cccc3CCCCc23)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C22H22ClN3O2/c23-17-8-3-5-15(13-17)14-20(22(28)25-12-11-24)26-21(27)19-10-4-7-16-6-1-2-9-18(16)19/h3-5,7-8,10,13,20H,1-2,6,9,12,14H2,(H,25,28)(H,26,27)/t20-/m0/s1
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n/an/a 398n/an/an/an/a7.037



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Procathepsin L [114-333,T223A]


(Homo sapiens (Human))		BDBM31988
PNG
(Dipeptidyl nitrile inhibitor, 21)
Show SMILES Cc1nc(C)c(s1)C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C17H17ClN4O2S/c1-10-15(25-11(2)21-10)17(24)22-14(16(23)20-7-6-19)9-12-4-3-5-13(18)8-12/h3-5,8,14H,7,9H2,1-2H3,(H,20,23)(H,22,24)/t14-/m0/s1
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AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Procathepsin L [114-333,T223A]


(Homo sapiens (Human))		BDBM31972
PNG
(Dipeptidyl nitrile inhibitor, 5)
Show SMILES Clc1cccc(C[C@H](NC(=O)C2=CCCCC2)C(=O)NCC#N)c1 |r,t:11|
Show InChI InChI=1S/C18H20ClN3O2/c19-15-8-4-5-13(11-15)12-16(18(24)21-10-9-20)22-17(23)14-6-2-1-3-7-14/h4-6,8,11,16H,1-3,7,10,12H2,(H,21,24)(H,22,23)/t16-/m0/s1
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n/an/a 501n/an/an/an/a7.037



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin L2


(Homo sapiens (Human))		BDBM31990
PNG
(Dipeptidyl nitrile inhibitor, 23)
Show SMILES CCc1cc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)n(C)n1 |r|
Show InChI InChI=1S/C18H20ClN5O2/c1-3-14-11-16(24(2)23-14)18(26)22-15(17(25)21-8-7-20)10-12-5-4-6-13(19)9-12/h4-6,9,11,15H,3,8,10H2,1-2H3,(H,21,25)(H,22,26)/t15-/m0/s1
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n/an/a 501n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin L2


(Homo sapiens (Human))		BDBM31991
PNG
(Dipeptidyl nitrile inhibitor, 24)
Show SMILES CC(C)c1cc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)n(C)n1 |r|
Show InChI InChI=1S/C19H22ClN5O2/c1-12(2)15-11-17(25(3)24-15)19(27)23-16(18(26)22-8-7-21)10-13-5-4-6-14(20)9-13/h4-6,9,11-12,16H,8,10H2,1-3H3,(H,22,26)(H,23,27)/t16-/m0/s1
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n/an/a 501n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin L2


(Homo sapiens (Human))		BDBM31989
PNG
(Dipeptidyl nitrile inhibitor, 22)
Show SMILES Cc1cc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)c(C)s1 |r|
Show InChI InChI=1S/C18H18ClN3O2S/c1-11-8-15(12(2)25-11)17(23)22-16(18(24)21-7-6-20)10-13-4-3-5-14(19)9-13/h3-5,8-9,16H,7,10H2,1-2H3,(H,21,24)(H,22,23)/t16-/m0/s1
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AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Procathepsin L [114-333,T223A]


(Homo sapiens (Human))		BDBM31986
PNG
(Dipeptidyl nitrile inhibitor, 19)
Show SMILES Cc1cc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)n(C)n1 |r|
Show InChI InChI=1S/C17H18ClN5O2/c1-11-8-15(23(2)22-11)17(25)21-14(16(24)20-7-6-19)10-12-4-3-5-13(18)9-12/h3-5,8-9,14H,7,10H2,1-2H3,(H,20,24)(H,21,25)/t14-/m0/s1
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n/an/a 501n/an/an/an/a7.037



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Procathepsin L [114-333,T223A]


(Homo sapiens (Human))		BDBM31987
PNG
(Dipeptidyl nitrile inhibitor, 20)
Show SMILES Cc1nc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)c(C)o1 |r|
Show InChI InChI=1S/C17H17ClN4O3/c1-10-15(21-11(2)25-10)17(24)22-14(16(23)20-7-6-19)9-12-4-3-5-13(18)8-12/h3-5,8,14H,7,9H2,1-2H3,(H,20,23)(H,22,24)/t14-/m0/s1
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n/an/a 631n/an/an/an/a7.037



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))		BDBM31974
PNG
(Dipeptidyl nitrile inhibitor, 7)
Show SMILES Cc1ccc(cc1)C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C19H18ClN3O2/c1-13-5-7-15(8-6-13)18(24)23-17(19(25)22-10-9-21)12-14-3-2-4-16(20)11-14/h2-8,11,17H,10,12H2,1H3,(H,22,25)(H,23,24)/t17-/m0/s1
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AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))		BDBM31990
PNG
(Dipeptidyl nitrile inhibitor, 23)
Show SMILES CCc1cc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)n(C)n1 |r|
Show InChI InChI=1S/C18H20ClN5O2/c1-3-14-11-16(24(2)23-14)18(26)22-15(17(25)21-8-7-20)10-12-5-4-6-13(19)9-12/h4-6,9,11,15H,3,8,10H2,1-2H3,(H,21,25)(H,22,26)/t15-/m0/s1
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n/an/a 794n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))		BDBM31991
PNG
(Dipeptidyl nitrile inhibitor, 24)
Show SMILES CC(C)c1cc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)n(C)n1 |r|
Show InChI InChI=1S/C19H22ClN5O2/c1-12(2)15-11-17(25(3)24-15)19(27)23-16(18(26)22-8-7-21)10-13-5-4-6-14(20)9-13/h4-6,9,11-12,16H,8,10H2,1-3H3,(H,22,26)(H,23,27)/t16-/m0/s1
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AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))		BDBM31986
PNG
(Dipeptidyl nitrile inhibitor, 19)
Show SMILES Cc1cc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)n(C)n1 |r|
Show InChI InChI=1S/C17H18ClN5O2/c1-11-8-15(23(2)22-11)17(25)21-14(16(24)20-7-6-19)10-12-4-3-5-13(18)9-12/h3-5,8-9,14H,7,10H2,1-2H3,(H,20,24)(H,21,25)/t14-/m0/s1
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n/an/a 794n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))		BDBM31987
PNG
(Dipeptidyl nitrile inhibitor, 20)
Show SMILES Cc1nc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)c(C)o1 |r|
Show InChI InChI=1S/C17H17ClN4O3/c1-10-15(21-11(2)25-10)17(24)22-14(16(23)20-7-6-19)9-12-4-3-5-13(18)8-12/h3-5,8,14H,7,9H2,1-2H3,(H,20,23)(H,22,24)/t14-/m0/s1
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n/an/a 794n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))		BDBM31989
PNG
(Dipeptidyl nitrile inhibitor, 22)
Show SMILES Cc1cc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)c(C)s1 |r|
Show InChI InChI=1S/C18H18ClN3O2S/c1-11-8-15(12(2)25-11)17(23)22-16(18(24)21-7-6-20)10-13-4-3-5-14(19)9-13/h3-5,8-9,16H,7,10H2,1-2H3,(H,21,24)(H,22,23)/t16-/m0/s1
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n/an/a 794n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin L2


(Homo sapiens (Human))		BDBM31970
PNG
(Dipeptidyl nitrile inhibitor, 1)
Show SMILES Clc1cccc(C[C@H](NC(=O)c2ccccc2)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C18H16ClN3O2/c19-15-8-4-5-13(11-15)12-16(18(24)21-10-9-20)22-17(23)14-6-2-1-3-7-14/h1-8,11,16H,10,12H2,(H,21,24)(H,22,23)/t16-/m0/s1
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n/an/a 794n/an/an/an/a7.037



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin L2


(Homo sapiens (Human))		BDBM31975
PNG
(Dipeptidyl nitrile inhibitor, 8)
Show SMILES Cc1cccc(c1)C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C19H18ClN3O2/c1-13-4-2-6-15(10-13)18(24)23-17(19(25)22-9-8-21)12-14-5-3-7-16(20)11-14/h2-7,10-11,17H,9,12H2,1H3,(H,22,25)(H,23,24)/t17-/m0/s1
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n/an/a 794n/an/an/an/a7.037



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))		BDBM31993
PNG
(Dipeptidyl nitrile inhibitor, 26)
Show SMILES Cc1cccc(C[C@H](NC(=O)c2cc(nn2C)C(C)(C)C)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C21H27N5O2/c1-14-7-6-8-15(11-14)12-16(19(27)23-10-9-22)24-20(28)17-13-18(21(2,3)4)25-26(17)5/h6-8,11,13,16H,10,12H2,1-5H3,(H,23,27)(H,24,28)/t16-/m0/s1
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n/an/a 794n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Procathepsin L [114-333,T223A]


(Homo sapiens (Human))		BDBM31976
PNG
(Dipeptidyl nitrile inhibitor, 9)
Show SMILES Cc1ccccc1C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C19H18ClN3O2/c1-13-5-2-3-8-16(13)18(24)23-17(19(25)22-10-9-21)12-14-6-4-7-15(20)11-14/h2-8,11,17H,10,12H2,1H3,(H,22,25)(H,23,24)/t17-/m0/s1
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n/an/a 794n/an/an/an/a7.037



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin L2


(Homo sapiens (Human))		BDBM31974
PNG
(Dipeptidyl nitrile inhibitor, 7)
Show SMILES Cc1ccc(cc1)C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C19H18ClN3O2/c1-13-5-7-15(8-6-13)18(24)23-17(19(25)22-10-9-21)12-14-3-2-4-16(20)11-14/h2-8,11,17H,10,12H2,1H3,(H,22,25)(H,23,24)/t17-/m0/s1
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n/an/a 1.00E+3n/an/an/an/a7.037



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin L2


(Homo sapiens (Human))		BDBM31984
PNG
(Dipeptidyl nitrile inhibitor, 17)
Show SMILES Cc1ccc2cc(C)cc(C(=O)N[C@@H](Cc3cccc(Cl)c3)C(=O)NCC#N)c2c1 |r|
Show InChI InChI=1S/C24H22ClN3O2/c1-15-6-7-18-10-16(2)12-21(20(18)11-15)23(29)28-22(24(30)27-9-8-26)14-17-4-3-5-19(25)13-17/h3-7,10-13,22H,9,14H2,1-2H3,(H,27,30)(H,28,29)/t22-/m0/s1
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AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))		BDBM31992
PNG
(Dipeptidyl nitrile inhibitor, 25)
Show SMILES Cn1nc(cc1C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N)C(C)(C)C |r|
Show InChI InChI=1S/C20H24ClN5O2/c1-20(2,3)17-12-16(26(4)25-17)19(28)24-15(18(27)23-9-8-22)11-13-6-5-7-14(21)10-13/h5-7,10,12,15H,9,11H2,1-4H3,(H,23,27)(H,24,28)/t15-/m0/s1
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n/an/a 1.00E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))		BDBM31984
PNG
(Dipeptidyl nitrile inhibitor, 17)
Show SMILES Cc1ccc2cc(C)cc(C(=O)N[C@@H](Cc3cccc(Cl)c3)C(=O)NCC#N)c2c1 |r|
Show InChI InChI=1S/C24H22ClN3O2/c1-15-6-7-18-10-16(2)12-21(20(18)11-15)23(29)28-22(24(30)27-9-8-26)14-17-4-3-5-19(25)13-17/h3-7,10-13,22H,9,14H2,1-2H3,(H,27,30)(H,28,29)/t22-/m0/s1
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n/an/a 1.00E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))		BDBM31988
PNG
(Dipeptidyl nitrile inhibitor, 21)
Show SMILES Cc1nc(C)c(s1)C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C17H17ClN4O2S/c1-10-15(25-11(2)21-10)17(24)22-14(16(23)20-7-6-19)9-12-4-3-5-13(18)8-12/h3-5,8,14H,7,9H2,1-2H3,(H,20,23)(H,22,24)/t14-/m0/s1
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n/an/a 1.26E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))		BDBM31978
PNG
(Dipeptidyl nitrile inhibitor, 11)
Show SMILES Cc1ccc(C)c(c1)C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C20H20ClN3O2/c1-13-6-7-14(2)17(10-13)19(25)24-18(20(26)23-9-8-22)12-15-4-3-5-16(21)11-15/h3-7,10-11,18H,9,12H2,1-2H3,(H,23,26)(H,24,25)/t18-/m0/s1
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n/an/a 1.26E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))		BDBM31985
PNG
(Dipeptidyl nitrile inhibitor, 18)
Show SMILES Cc1nn(C)cc1C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C17H18ClN5O2/c1-11-14(10-23(2)22-11)16(24)21-15(17(25)20-7-6-19)9-12-4-3-5-13(18)8-12/h3-5,8,10,15H,7,9H2,1-2H3,(H,20,25)(H,21,24)/t15-/m0/s1
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AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Procathepsin L [114-333,T223A]


(Homo sapiens (Human))		BDBM31971
PNG
(Dipeptidyl nitrile inhibitor, 4)
Show SMILES Clc1cccc(C[C@H](NC(=O)C2CCCCC2)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C18H22ClN3O2/c19-15-8-4-5-13(11-15)12-16(18(24)21-10-9-20)22-17(23)14-6-2-1-3-7-14/h4-5,8,11,14,16H,1-3,6-7,10,12H2,(H,21,24)(H,22,23)/t16-/m0/s1
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AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Procathepsin L [114-333,T223A]


(Homo sapiens (Human))		BDBM31985
PNG
(Dipeptidyl nitrile inhibitor, 18)
Show SMILES Cc1nn(C)cc1C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C17H18ClN5O2/c1-11-14(10-23(2)22-11)16(24)21-15(17(25)20-7-6-19)9-12-4-3-5-13(18)8-12/h3-5,8,10,15H,7,9H2,1-2H3,(H,20,25)(H,21,24)/t15-/m0/s1
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AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))		BDBM31974
PNG
(Dipeptidyl nitrile inhibitor, 7)
Show SMILES Cc1ccc(cc1)C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C19H18ClN3O2/c1-13-5-7-15(8-6-13)18(24)23-17(19(25)22-10-9-21)12-14-3-2-4-16(20)11-14/h2-8,11,17H,10,12H2,1H3,(H,22,25)(H,23,24)/t17-/m0/s1
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AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin L2


(Homo sapiens (Human))		BDBM31986
PNG
(Dipeptidyl nitrile inhibitor, 19)
Show SMILES Cc1cc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)n(C)n1 |r|
Show InChI InChI=1S/C17H18ClN5O2/c1-11-8-15(23(2)22-11)17(25)21-14(16(24)20-7-6-19)10-12-4-3-5-13(18)9-12/h3-5,8-9,14H,7,10H2,1-2H3,(H,20,24)(H,21,25)/t14-/m0/s1
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AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin L2


(Homo sapiens (Human))		BDBM31985
PNG
(Dipeptidyl nitrile inhibitor, 18)
Show SMILES Cc1nn(C)cc1C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C17H18ClN5O2/c1-11-14(10-23(2)22-11)16(24)21-15(17(25)20-7-6-19)9-12-4-3-5-13(18)8-12/h3-5,8,10,15H,7,9H2,1-2H3,(H,20,25)(H,21,24)/t15-/m0/s1
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AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))		BDBM31976
PNG
(Dipeptidyl nitrile inhibitor, 9)
Show SMILES Cc1ccccc1C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C19H18ClN3O2/c1-13-5-2-3-8-16(13)18(24)23-17(19(25)22-10-9-21)12-14-6-4-7-15(20)11-14/h2-8,11,17H,10,12H2,1H3,(H,22,25)(H,23,24)/t17-/m0/s1
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n/an/a 1.59E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin L2


(Homo sapiens (Human))		BDBM31978
PNG
(Dipeptidyl nitrile inhibitor, 11)
Show SMILES Cc1ccc(C)c(c1)C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C20H20ClN3O2/c1-13-6-7-14(2)17(10-13)19(25)24-18(20(26)23-9-8-22)12-15-4-3-5-16(21)11-15/h3-7,10-11,18H,9,12H2,1-2H3,(H,23,26)(H,24,25)/t18-/m0/s1
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n/an/a 1.59E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))		BDBM31989
PNG
(Dipeptidyl nitrile inhibitor, 22)
Show SMILES Cc1cc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)c(C)s1 |r|
Show InChI InChI=1S/C18H18ClN3O2S/c1-11-8-15(12(2)25-11)17(23)22-16(18(24)21-7-6-20)10-13-4-3-5-14(19)9-13/h3-5,8-9,16H,7,10H2,1-2H3,(H,21,24)(H,22,23)/t16-/m0/s1
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n/an/a 2.00E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))		BDBM31991
PNG
(Dipeptidyl nitrile inhibitor, 24)
Show SMILES CC(C)c1cc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)n(C)n1 |r|
Show InChI InChI=1S/C19H22ClN5O2/c1-12(2)15-11-17(25(3)24-15)19(27)23-16(18(26)22-8-7-21)10-13-5-4-6-14(20)9-13/h4-6,9,11-12,16H,8,10H2,1-3H3,(H,22,26)(H,23,27)/t16-/m0/s1
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n/an/a 2.00E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))		BDBM31979
PNG
(Dipeptidyl nitrile inhibitor, 12)
Show SMILES Cc1cccc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)c1C |r|
Show InChI InChI=1S/C20H20ClN3O2/c1-13-5-3-8-17(14(13)2)19(25)24-18(20(26)23-10-9-22)12-15-6-4-7-16(21)11-15/h3-8,11,18H,10,12H2,1-2H3,(H,23,26)(H,24,25)/t18-/m0/s1
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n/an/a 2.00E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))		BDBM31972
PNG
(Dipeptidyl nitrile inhibitor, 5)
Show SMILES Clc1cccc(C[C@H](NC(=O)C2=CCCCC2)C(=O)NCC#N)c1 |r,t:11|
Show InChI InChI=1S/C18H20ClN3O2/c19-15-8-4-5-13(11-15)12-16(18(24)21-10-9-20)22-17(23)14-6-2-1-3-7-14/h4-6,8,11,16H,1-3,7,10,12H2,(H,21,24)(H,22,23)/t16-/m0/s1
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n/an/a 2.00E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))		BDBM31974
PNG
(Dipeptidyl nitrile inhibitor, 7)
Show SMILES Cc1ccc(cc1)C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C19H18ClN3O2/c1-13-5-7-15(8-6-13)18(24)23-17(19(25)22-10-9-21)12-14-3-2-4-16(20)11-14/h2-8,11,17H,10,12H2,1H3,(H,22,25)(H,23,24)/t17-/m0/s1
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n/an/a 2.51E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))		BDBM31973
PNG
(Dipeptidyl nitrile inhibitor, 6)
Show SMILES Clc1cccc(C[C@H](NC(=O)C2CCCCCC2)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C19H24ClN3O2/c20-16-9-5-6-14(12-16)13-17(19(25)22-11-10-21)23-18(24)15-7-3-1-2-4-8-15/h5-6,9,12,15,17H,1-4,7-8,11,13H2,(H,22,25)(H,23,24)/t17-/m0/s1
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n/an/a 2.51E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))		BDBM31993
PNG
(Dipeptidyl nitrile inhibitor, 26)
Show SMILES Cc1cccc(C[C@H](NC(=O)c2cc(nn2C)C(C)(C)C)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C21H27N5O2/c1-14-7-6-8-15(11-14)12-16(19(27)23-10-9-22)24-20(28)17-13-18(21(2,3)4)25-26(17)5/h6-8,11,13,16H,10,12H2,1-5H3,(H,23,27)(H,24,28)/t16-/m0/s1
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n/an/a 2.51E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin L2


(Homo sapiens (Human))		BDBM31987
PNG
(Dipeptidyl nitrile inhibitor, 20)
Show SMILES Cc1nc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)c(C)o1 |r|
Show InChI InChI=1S/C17H17ClN4O3/c1-10-15(21-11(2)25-10)17(24)22-14(16(23)20-7-6-19)9-12-4-3-5-13(18)8-12/h3-5,8,14H,7,9H2,1-2H3,(H,20,23)(H,22,24)/t14-/m0/s1
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n/an/a 2.51E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))		BDBM31971
PNG
(Dipeptidyl nitrile inhibitor, 4)
Show SMILES Clc1cccc(C[C@H](NC(=O)C2CCCCC2)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C18H22ClN3O2/c19-15-8-4-5-13(11-15)12-16(18(24)21-10-9-20)22-17(23)14-6-2-1-3-7-14/h4-5,8,11,14,16H,1-3,6-7,10,12H2,(H,21,24)(H,22,23)/t16-/m0/s1
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n/an/a 2.51E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))		BDBM31985
PNG
(Dipeptidyl nitrile inhibitor, 18)
Show SMILES Cc1nn(C)cc1C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C17H18ClN5O2/c1-11-14(10-23(2)22-11)16(24)21-15(17(25)20-7-6-19)9-12-4-3-5-13(18)8-12/h3-5,8,10,15H,7,9H2,1-2H3,(H,20,25)(H,21,24)/t15-/m0/s1
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n/an/a 2.51E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))		BDBM31983
PNG
(Dipeptidyl nitrile inhibitor, 16)
Show SMILES Clc1cccc(C[C@H](NC(=O)c2ccnc3ccccc23)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C21H17ClN4O2/c22-15-5-3-4-14(12-15)13-19(21(28)25-11-9-23)26-20(27)17-8-10-24-18-7-2-1-6-16(17)18/h1-8,10,12,19H,11,13H2,(H,25,28)(H,26,27)/t19-/m0/s1
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n/an/a 3.16E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))		BDBM31992
PNG
(Dipeptidyl nitrile inhibitor, 25)
Show SMILES Cn1nc(cc1C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N)C(C)(C)C |r|
Show InChI InChI=1S/C20H24ClN5O2/c1-20(2,3)17-12-16(26(4)25-17)19(28)24-15(18(27)23-9-8-22)11-13-6-5-7-14(21)10-13/h5-7,10,12,15H,9,11H2,1-4H3,(H,23,27)(H,24,28)/t15-/m0/s1
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n/an/a 3.16E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))		BDBM31981
PNG
(Dipeptidyl nitrile inhibitor, 14)
Show SMILES Clc1cccc(C[C@H](NC(=O)c2cccc3ccccc23)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C22H18ClN3O2/c23-17-8-3-5-15(13-17)14-20(22(28)25-12-11-24)26-21(27)19-10-4-7-16-6-1-2-9-18(16)19/h1-10,13,20H,12,14H2,(H,25,28)(H,26,27)/t20-/m0/s1
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n/an/a 3.16E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin L2


(Homo sapiens (Human))		BDBM31983
PNG
(Dipeptidyl nitrile inhibitor, 16)
Show SMILES Clc1cccc(C[C@H](NC(=O)c2ccnc3ccccc23)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C21H17ClN4O2/c22-15-5-3-4-14(12-15)13-19(21(28)25-11-9-23)26-20(27)17-8-10-24-18-7-2-1-6-16(17)18/h1-8,10,12,19H,11,13H2,(H,25,28)(H,26,27)/t19-/m0/s1
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n/an/a 3.16E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))		BDBM31970
PNG
(Dipeptidyl nitrile inhibitor, 1)
Show SMILES Clc1cccc(C[C@H](NC(=O)c2ccccc2)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C18H16ClN3O2/c19-15-8-4-5-13(11-15)12-16(18(24)21-10-9-20)22-17(23)14-6-2-1-3-7-14/h1-8,11,16H,10,12H2,(H,21,24)(H,22,23)/t16-/m0/s1
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n/an/a 3.16E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))		BDBM31977
PNG
(Dipeptidyl nitrile inhibitor, 10)
Show SMILES Clc1cccc(C[C@H](NC(=O)c2cccc(Cl)c2)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C18H15Cl2N3O2/c19-14-5-1-3-12(9-14)10-16(18(25)22-8-7-21)23-17(24)13-4-2-6-15(20)11-13/h1-6,9,11,16H,8,10H2,(H,22,25)(H,23,24)/t16-/m0/s1
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n/an/a 3.98E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin L2


(Homo sapiens (Human))		BDBM31979
PNG
(Dipeptidyl nitrile inhibitor, 12)
Show SMILES Cc1cccc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)c1C |r|
Show InChI InChI=1S/C20H20ClN3O2/c1-13-5-3-8-17(14(13)2)19(25)24-18(20(26)23-10-9-22)12-15-6-4-7-16(21)11-15/h3-8,11,18H,10,12H2,1-2H3,(H,23,26)(H,24,25)/t18-/m0/s1
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AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))		BDBM31993
PNG
(Dipeptidyl nitrile inhibitor, 26)
Show SMILES Cc1cccc(C[C@H](NC(=O)c2cc(nn2C)C(C)(C)C)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C21H27N5O2/c1-14-7-6-8-15(11-14)12-16(19(27)23-10-9-22)24-20(28)17-13-18(21(2,3)4)25-26(17)5/h6-8,11,13,16H,10,12H2,1-5H3,(H,23,27)(H,24,28)/t16-/m0/s1
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n/an/a 3.98E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin L2


(Homo sapiens (Human))		BDBM31981
PNG
(Dipeptidyl nitrile inhibitor, 14)
Show SMILES Clc1cccc(C[C@H](NC(=O)c2cccc3ccccc23)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C22H18ClN3O2/c23-17-8-3-5-15(13-17)14-20(22(28)25-12-11-24)26-21(27)19-10-4-7-16-6-1-2-9-18(16)19/h1-10,13,20H,12,14H2,(H,25,28)(H,26,27)/t20-/m0/s1
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n/an/a 3.98E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))		BDBM31990
PNG
(Dipeptidyl nitrile inhibitor, 23)
Show SMILES CCc1cc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)n(C)n1 |r|
Show InChI InChI=1S/C18H20ClN5O2/c1-3-14-11-16(24(2)23-14)18(26)22-15(17(25)21-8-7-20)10-12-5-4-6-13(19)9-12/h4-6,9,11,15H,3,8,10H2,1-2H3,(H,21,25)(H,22,26)/t15-/m0/s1
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n/an/a 5.01E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))		BDBM31970
PNG
(Dipeptidyl nitrile inhibitor, 1)
Show SMILES Clc1cccc(C[C@H](NC(=O)c2ccccc2)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C18H16ClN3O2/c19-15-8-4-5-13(11-15)12-16(18(24)21-10-9-20)22-17(23)14-6-2-1-3-7-14/h1-8,11,16H,10,12H2,(H,21,24)(H,22,23)/t16-/m0/s1
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n/an/a 5.01E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))		BDBM31973
PNG
(Dipeptidyl nitrile inhibitor, 6)
Show SMILES Clc1cccc(C[C@H](NC(=O)C2CCCCCC2)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C19H24ClN3O2/c20-16-9-5-6-14(12-16)13-17(19(25)22-11-10-21)23-18(24)15-7-3-1-2-4-8-15/h5-6,9,12,15,17H,1-4,7-8,11,13H2,(H,22,25)(H,23,24)/t17-/m0/s1
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n/an/a 5.01E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))		BDBM31975
PNG
(Dipeptidyl nitrile inhibitor, 8)
Show SMILES Cc1cccc(c1)C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C19H18ClN3O2/c1-13-4-2-6-15(10-13)18(24)23-17(19(25)22-9-8-21)12-14-5-3-7-16(20)11-14/h2-7,10-11,17H,9,12H2,1H3,(H,22,25)(H,23,24)/t17-/m0/s1
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n/an/a 5.01E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))		BDBM31991
PNG
(Dipeptidyl nitrile inhibitor, 24)
Show SMILES CC(C)c1cc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)n(C)n1 |r|
Show InChI InChI=1S/C19H22ClN5O2/c1-12(2)15-11-17(25(3)24-15)19(27)23-16(18(26)22-8-7-21)10-13-5-4-6-14(20)9-13/h4-6,9,11-12,16H,8,10H2,1-3H3,(H,22,26)(H,23,27)/t16-/m0/s1
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n/an/a 5.01E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))		BDBM31980
PNG
(Dipeptidyl nitrile inhibitor, 13)
Show SMILES Cc1cc(C)cc(c1)C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C20H20ClN3O2/c1-13-8-14(2)10-16(9-13)19(25)24-18(20(26)23-7-6-22)12-15-4-3-5-17(21)11-15/h3-5,8-11,18H,7,12H2,1-2H3,(H,23,26)(H,24,25)/t18-/m0/s1
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n/an/a 5.01E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))		BDBM31978
PNG
(Dipeptidyl nitrile inhibitor, 11)
Show SMILES Cc1ccc(C)c(c1)C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C20H20ClN3O2/c1-13-6-7-14(2)17(10-13)19(25)24-18(20(26)23-9-8-22)12-15-4-3-5-16(21)11-15/h3-7,10-11,18H,9,12H2,1-2H3,(H,23,26)(H,24,25)/t18-/m0/s1
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n/an/a 5.01E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))		BDBM31976
PNG
(Dipeptidyl nitrile inhibitor, 9)
Show SMILES Cc1ccccc1C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C19H18ClN3O2/c1-13-5-2-3-8-16(13)18(24)23-17(19(25)22-10-9-21)12-14-6-4-7-15(20)11-14/h2-8,11,17H,10,12H2,1H3,(H,22,25)(H,23,24)/t17-/m0/s1
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n/an/a 5.01E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))		BDBM31989
PNG
(Dipeptidyl nitrile inhibitor, 22)
Show SMILES Cc1cc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)c(C)s1 |r|
Show InChI InChI=1S/C18H18ClN3O2S/c1-11-8-15(12(2)25-11)17(23)22-16(18(24)21-7-6-20)10-13-4-3-5-14(19)9-13/h3-5,8-9,16H,7,10H2,1-2H3,(H,21,24)(H,22,23)/t16-/m0/s1
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n/an/a 5.01E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin L2


(Homo sapiens (Human))		BDBM31976
PNG
(Dipeptidyl nitrile inhibitor, 9)
Show SMILES Cc1ccccc1C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C19H18ClN3O2/c1-13-5-2-3-8-16(13)18(24)23-17(19(25)22-10-9-21)12-14-6-4-7-15(20)11-14/h2-8,11,17H,10,12H2,1H3,(H,22,25)(H,23,24)/t17-/m0/s1
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n/an/a 5.01E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))		BDBM31978
PNG
(Dipeptidyl nitrile inhibitor, 11)
Show SMILES Cc1ccc(C)c(c1)C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C20H20ClN3O2/c1-13-6-7-14(2)17(10-13)19(25)24-18(20(26)23-9-8-22)12-15-4-3-5-16(21)11-15/h3-7,10-11,18H,9,12H2,1-2H3,(H,23,26)(H,24,25)/t18-/m0/s1
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n/an/a 6.31E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))		BDBM31975
PNG
(Dipeptidyl nitrile inhibitor, 8)
Show SMILES Cc1cccc(c1)C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C19H18ClN3O2/c1-13-4-2-6-15(10-13)18(24)23-17(19(25)22-9-8-21)12-14-5-3-7-16(20)11-14/h2-7,10-11,17H,9,12H2,1H3,(H,22,25)(H,23,24)/t17-/m0/s1
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n/an/a 6.31E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))		BDBM31986
PNG
(Dipeptidyl nitrile inhibitor, 19)
Show SMILES Cc1cc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)n(C)n1 |r|
Show InChI InChI=1S/C17H18ClN5O2/c1-11-8-15(23(2)22-11)17(25)21-14(16(24)20-7-6-19)10-12-4-3-5-13(18)9-12/h3-5,8-9,14H,7,10H2,1-2H3,(H,20,24)(H,21,25)/t14-/m0/s1
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n/an/a 6.31E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))		BDBM31992
PNG
(Dipeptidyl nitrile inhibitor, 25)
Show SMILES Cn1nc(cc1C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N)C(C)(C)C |r|
Show InChI InChI=1S/C20H24ClN5O2/c1-20(2,3)17-12-16(26(4)25-17)19(28)24-15(18(27)23-9-8-22)11-13-6-5-7-14(21)10-13/h5-7,10,12,15H,9,11H2,1-4H3,(H,23,27)(H,24,28)/t15-/m0/s1
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n/an/a 6.31E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))		BDBM31977
PNG
(Dipeptidyl nitrile inhibitor, 10)
Show SMILES Clc1cccc(C[C@H](NC(=O)c2cccc(Cl)c2)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C18H15Cl2N3O2/c19-14-5-1-3-12(9-14)10-16(18(25)22-8-7-21)23-17(24)13-4-2-6-15(20)11-13/h1-6,9,11,16H,8,10H2,(H,22,25)(H,23,24)/t16-/m0/s1
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n/an/a 6.31E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin L2


(Homo sapiens (Human))		BDBM31973
PNG
(Dipeptidyl nitrile inhibitor, 6)
Show SMILES Clc1cccc(C[C@H](NC(=O)C2CCCCCC2)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C19H24ClN3O2/c20-16-9-5-6-14(12-16)13-17(19(25)22-11-10-21)23-18(24)15-7-3-1-2-4-8-15/h5-6,9,12,15,17H,1-4,7-8,11,13H2,(H,22,25)(H,23,24)/t17-/m0/s1
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n/an/a 6.31E+3n/an/an/an/a7.037



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin L2


(Homo sapiens (Human))		BDBM31971
PNG
(Dipeptidyl nitrile inhibitor, 4)
Show SMILES Clc1cccc(C[C@H](NC(=O)C2CCCCC2)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C18H22ClN3O2/c19-15-8-4-5-13(11-15)12-16(18(24)21-10-9-20)22-17(23)14-6-2-1-3-7-14/h4-5,8,11,14,16H,1-3,6-7,10,12H2,(H,21,24)(H,22,23)/t16-/m0/s1
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AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))		BDBM31980
PNG
(Dipeptidyl nitrile inhibitor, 13)
Show SMILES Cc1cc(C)cc(c1)C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C20H20ClN3O2/c1-13-8-14(2)10-16(9-13)19(25)24-18(20(26)23-7-6-22)12-15-4-3-5-17(21)11-15/h3-5,8-11,18H,7,12H2,1-2H3,(H,23,26)(H,24,25)/t18-/m0/s1
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n/an/a 7.94E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))		BDBM31990
PNG
(Dipeptidyl nitrile inhibitor, 23)
Show SMILES CCc1cc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)n(C)n1 |r|
Show InChI InChI=1S/C18H20ClN5O2/c1-3-14-11-16(24(2)23-14)18(26)22-15(17(25)21-8-7-20)10-12-5-4-6-13(19)9-12/h4-6,9,11,15H,3,8,10H2,1-2H3,(H,21,25)(H,22,26)/t15-/m0/s1
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n/an/a 7.94E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))		BDBM31972
PNG
(Dipeptidyl nitrile inhibitor, 5)
Show SMILES Clc1cccc(C[C@H](NC(=O)C2=CCCCC2)C(=O)NCC#N)c1 |r,t:11|
Show InChI InChI=1S/C18H20ClN3O2/c19-15-8-4-5-13(11-15)12-16(18(24)21-10-9-20)22-17(23)14-6-2-1-3-7-14/h4-6,8,11,16H,1-3,7,10,12H2,(H,21,24)(H,22,23)/t16-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))		BDBM31976
PNG
(Dipeptidyl nitrile inhibitor, 9)
Show SMILES Cc1ccccc1C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C19H18ClN3O2/c1-13-5-2-3-8-16(13)18(24)23-17(19(25)22-10-9-21)12-14-6-4-7-15(20)11-14/h2-8,11,17H,10,12H2,1H3,(H,22,25)(H,23,24)/t17-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))		BDBM31985
PNG
(Dipeptidyl nitrile inhibitor, 18)
Show SMILES Cc1nn(C)cc1C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C17H18ClN5O2/c1-11-14(10-23(2)22-11)16(24)21-15(17(25)20-7-6-19)9-12-4-3-5-13(18)8-12/h3-5,8,10,15H,7,9H2,1-2H3,(H,20,25)(H,21,24)/t15-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))		BDBM31986
PNG
(Dipeptidyl nitrile inhibitor, 19)
Show SMILES Cc1cc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)n(C)n1 |r|
Show InChI InChI=1S/C17H18ClN5O2/c1-11-8-15(23(2)22-11)17(25)21-14(16(24)20-7-6-19)10-12-4-3-5-13(18)9-12/h3-5,8-9,14H,7,10H2,1-2H3,(H,20,24)(H,21,25)/t14-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))		BDBM31979
PNG
(Dipeptidyl nitrile inhibitor, 12)
Show SMILES Cc1cccc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)c1C |r|
Show InChI InChI=1S/C20H20ClN3O2/c1-13-5-3-8-17(14(13)2)19(25)24-18(20(26)23-10-9-22)12-15-6-4-7-16(21)11-15/h3-8,11,18H,10,12H2,1-2H3,(H,23,26)(H,24,25)/t18-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))		BDBM31982
PNG
(Dipeptidyl nitrile inhibitor, 15)
Show SMILES Clc1cccc(C[C@H](NC(=O)c2cccc3CCCCc23)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C22H22ClN3O2/c23-17-8-3-5-15(13-17)14-20(22(28)25-12-11-24)26-21(27)19-10-4-7-16-6-1-2-9-18(16)19/h3-5,7-8,10,13,20H,1-2,6,9,12,14H2,(H,25,28)(H,26,27)/t20-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))		BDBM31984
PNG
(Dipeptidyl nitrile inhibitor, 17)
Show SMILES Cc1ccc2cc(C)cc(C(=O)N[C@@H](Cc3cccc(Cl)c3)C(=O)NCC#N)c2c1 |r|
Show InChI InChI=1S/C24H22ClN3O2/c1-15-6-7-18-10-16(2)12-21(20(18)11-15)23(29)28-22(24(30)27-9-8-26)14-17-4-3-5-19(25)13-17/h3-7,10-13,22H,9,14H2,1-2H3,(H,27,30)(H,28,29)/t22-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))		BDBM31981
PNG
(Dipeptidyl nitrile inhibitor, 14)
Show SMILES Clc1cccc(C[C@H](NC(=O)c2cccc3ccccc23)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C22H18ClN3O2/c23-17-8-3-5-15(13-17)14-20(22(28)25-12-11-24)26-21(27)19-10-4-7-16-6-1-2-9-18(16)19/h1-10,13,20H,12,14H2,(H,25,28)(H,26,27)/t20-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))		BDBM31987
PNG
(Dipeptidyl nitrile inhibitor, 20)
Show SMILES Cc1nc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)c(C)o1 |r|
Show InChI InChI=1S/C17H17ClN4O3/c1-10-15(21-11(2)25-10)17(24)22-14(16(23)20-7-6-19)9-12-4-3-5-13(18)8-12/h3-5,8,14H,7,9H2,1-2H3,(H,20,23)(H,22,24)/t14-/m0/s1
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n/an/a 1.00E+4n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin L2


(Homo sapiens (Human))		BDBM31982
PNG
(Dipeptidyl nitrile inhibitor, 15)
Show SMILES Clc1cccc(C[C@H](NC(=O)c2cccc3CCCCc23)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C22H22ClN3O2/c23-17-8-3-5-15(13-17)14-20(22(28)25-12-11-24)26-21(27)19-10-4-7-16-6-1-2-9-18(16)19/h3-5,7-8,10,13,20H,1-2,6,9,12,14H2,(H,25,28)(H,26,27)/t20-/m0/s1
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AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))		BDBM31979
PNG
(Dipeptidyl nitrile inhibitor, 12)
Show SMILES Cc1cccc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)c1C |r|
Show InChI InChI=1S/C20H20ClN3O2/c1-13-5-3-8-17(14(13)2)19(25)24-18(20(26)23-10-9-22)12-15-6-4-7-16(21)11-15/h3-8,11,18H,10,12H2,1-2H3,(H,23,26)(H,24,25)/t18-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))		BDBM31982
PNG
(Dipeptidyl nitrile inhibitor, 15)
Show SMILES Clc1cccc(C[C@H](NC(=O)c2cccc3CCCCc23)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C22H22ClN3O2/c23-17-8-3-5-15(13-17)14-20(22(28)25-12-11-24)26-21(27)19-10-4-7-16-6-1-2-9-18(16)19/h3-5,7-8,10,13,20H,1-2,6,9,12,14H2,(H,25,28)(H,26,27)/t20-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))		BDBM31983
PNG
(Dipeptidyl nitrile inhibitor, 16)
Show SMILES Clc1cccc(C[C@H](NC(=O)c2ccnc3ccccc23)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C21H17ClN4O2/c22-15-5-3-4-14(12-15)13-19(21(28)25-11-9-23)26-20(27)17-8-10-24-18-7-2-1-6-16(17)18/h1-8,10,12,19H,11,13H2,(H,25,28)(H,26,27)/t19-/m0/s1
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AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))		BDBM31981
PNG
(Dipeptidyl nitrile inhibitor, 14)
Show SMILES Clc1cccc(C[C@H](NC(=O)c2cccc3ccccc23)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C22H18ClN3O2/c23-17-8-3-5-15(13-17)14-20(22(28)25-12-11-24)26-21(27)19-10-4-7-16-6-1-2-9-18(16)19/h1-10,13,20H,12,14H2,(H,25,28)(H,26,27)/t20-/m0/s1
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n/an/a 1.00E+4n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))		BDBM31983
PNG
(Dipeptidyl nitrile inhibitor, 16)
Show SMILES Clc1cccc(C[C@H](NC(=O)c2ccnc3ccccc23)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C21H17ClN4O2/c22-15-5-3-4-14(12-15)13-19(21(28)25-11-9-23)26-20(27)17-8-10-24-18-7-2-1-6-16(17)18/h1-8,10,12,19H,11,13H2,(H,25,28)(H,26,27)/t19-/m0/s1
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AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))		BDBM31971
PNG
(Dipeptidyl nitrile inhibitor, 4)
Show SMILES Clc1cccc(C[C@H](NC(=O)C2CCCCC2)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C18H22ClN3O2/c19-15-8-4-5-13(11-15)12-16(18(24)21-10-9-20)22-17(23)14-6-2-1-3-7-14/h4-5,8,11,14,16H,1-3,6-7,10,12H2,(H,21,24)(H,22,23)/t16-/m0/s1
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AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))		BDBM31982
PNG
(Dipeptidyl nitrile inhibitor, 15)
Show SMILES Clc1cccc(C[C@H](NC(=O)c2cccc3CCCCc23)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C22H22ClN3O2/c23-17-8-3-5-15(13-17)14-20(22(28)25-12-11-24)26-21(27)19-10-4-7-16-6-1-2-9-18(16)19/h3-5,7-8,10,13,20H,1-2,6,9,12,14H2,(H,25,28)(H,26,27)/t20-/m0/s1
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AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))		BDBM31971
PNG
(Dipeptidyl nitrile inhibitor, 4)
Show SMILES Clc1cccc(C[C@H](NC(=O)C2CCCCC2)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C18H22ClN3O2/c19-15-8-4-5-13(11-15)12-16(18(24)21-10-9-20)22-17(23)14-6-2-1-3-7-14/h4-5,8,11,14,16H,1-3,6-7,10,12H2,(H,21,24)(H,22,23)/t16-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))		BDBM31984
PNG
(Dipeptidyl nitrile inhibitor, 17)
Show SMILES Cc1ccc2cc(C)cc(C(=O)N[C@@H](Cc3cccc(Cl)c3)C(=O)NCC#N)c2c1 |r|
Show InChI InChI=1S/C24H22ClN3O2/c1-15-6-7-18-10-16(2)12-21(20(18)11-15)23(29)28-22(24(30)27-9-8-26)14-17-4-3-5-19(25)13-17/h3-7,10-13,22H,9,14H2,1-2H3,(H,27,30)(H,28,29)/t22-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))		BDBM31987
PNG
(Dipeptidyl nitrile inhibitor, 20)
Show SMILES Cc1nc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)c(C)o1 |r|
Show InChI InChI=1S/C17H17ClN4O3/c1-10-15(21-11(2)25-10)17(24)22-14(16(23)20-7-6-19)9-12-4-3-5-13(18)8-12/h3-5,8,14H,7,9H2,1-2H3,(H,20,23)(H,22,24)/t14-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))		BDBM31988
PNG
(Dipeptidyl nitrile inhibitor, 21)
Show SMILES Cc1nc(C)c(s1)C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N |r|
Show InChI InChI=1S/C17H17ClN4O2S/c1-10-15(25-11(2)21-10)17(24)22-14(16(23)20-7-6-19)9-12-4-3-5-13(18)8-12/h3-5,8,14H,7,9H2,1-2H3,(H,20,23)(H,22,24)/t14-/m0/s1
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n/an/a 1.00E+4n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))		BDBM31972
PNG
(Dipeptidyl nitrile inhibitor, 5)
Show SMILES Clc1cccc(C[C@H](NC(=O)C2=CCCCC2)C(=O)NCC#N)c1 |r,t:11|
Show InChI InChI=1S/C18H20ClN3O2/c19-15-8-4-5-13(11-15)12-16(18(24)21-10-9-20)22-17(23)14-6-2-1-3-7-14/h4-6,8,11,16H,1-3,7,10,12H2,(H,21,24)(H,22,23)/t16-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))		BDBM31973
PNG
(Dipeptidyl nitrile inhibitor, 6)
Show SMILES Clc1cccc(C[C@H](NC(=O)C2CCCCCC2)C(=O)NCC#N)c1 |r|
Show InChI InChI=1S/C19H24ClN3O2/c20-16-9-5-6-14(12-16)13-17(19(25)22-11-10-21)23-18(24)15-7-3-1-2-4-8-15/h5-6,9,12,15,17H,1-4,7-8,11,13H2,(H,22,25)(H,23,24)/t17-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



AstraZeneca



Assay Description
IC50 values for inhibition of Cathepsins were determined from dose dependent inhibition of cleavage of fluorogenic, AMC-tagged, peptide substrates.

Bioorg Med Chem Lett 19: 4280-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.071
BindingDB Entry DOI: 10.7270/Q2TT4PBM
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%