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PubMed code 15863311

Compile Data Set for Download or QSAR

Found 244 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
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11524
PNG
((2S,3S)-1-[(3S)-3-fluoropyrrolidin-1-yl]-1-oxo-3-{...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1cccc(c1)-c1nc(=O)o[nH]1 |r|
Show InChI InChI=1S/C22H23FN4O3/c1-13(19(24)21(28)27-10-9-18(23)12-27)14-5-7-15(8-6-14)16-3-2-4-17(11-16)20-25-22(29)30-26-20/h2-8,11,13,18-19H,9-10,12,24H2,1H3,(H,25,26,29)/p+1/t13-,18-,19-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11523
PNG
((2S,3S)-1-[(3S)-3-fluoropyrrolidin-1-yl]-1-oxo-3-{...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1cccc(c1)-c1nnn[nH]1 |r|
Show InChI InChI=1S/C21H23FN6O/c1-13(19(23)21(29)28-10-9-18(22)12-28)14-5-7-15(8-6-14)16-3-2-4-17(11-16)20-24-26-27-25-20/h2-8,11,13,18-19H,9-10,12,23H2,1H3,(H,24,25,26,27)/p+1/t13-,18-,19-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11503
PNG
((2S,3S)-1-[(3S)-3-fluoropyrrolidin-1-yl]-1-oxo-3-{...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1cccc(NS(=O)(=O)C(F)(F)F)c1 |r|
Show InChI InChI=1S/C21H23F4N3O3S/c1-13(19(26)20(29)28-10-9-17(22)12-28)14-5-7-15(8-6-14)16-3-2-4-18(11-16)27-32(30,31)21(23,24)25/h2-8,11,13,17,19,27H,9-10,12,26H2,1H3/p+1/t13-,17-,19-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11516
PNG
((2S,3S)-3-[4-(2,4-difluorophenyl)phenyl]-1-[(3S)-3...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1ccc(F)cc1F |r|
Show InChI InChI=1S/C20H21F3N2O/c1-12(19(24)20(26)25-9-8-16(22)11-25)13-2-4-14(5-3-13)17-7-6-15(21)10-18(17)23/h2-7,10,12,16,19H,8-9,11,24H2,1H3/p+1/t12-,16-,19-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11463
PNG
(CHEMBL22310 | N-{4-[(1S)-1-amino-2-[(3S)-3-fluorop...)
Show SMILES [H][C@@]1(CC[C@@H](CC1)NS(=O)(=O)c1ccc(F)cc1F)[C@H](N)C(=O)N1CC[C@H](F)C1 |r,wU:4.7,19.21,1.0,wD:1.1,26.28,(1.34,.92,;-.05,.24,;-.05,1.79,;-1.38,2.56,;-2.72,1.79,;-2.72,.24,;-1.38,-.53,;-4.05,2.56,;-5.38,1.78,;-6.47,.7,;-4.29,.7,;-6.72,2.55,;-6.72,4.1,;-8.05,4.87,;-9.38,4.1,;-10.72,4.87,;-9.38,2.55,;-8.05,1.78,;-8.05,.24,;1.29,-.53,;1.29,-2.07,;2.62,.24,;2.62,1.78,;3.95,-.53,;5.2,.38,;6.44,-.53,;5.97,-1.99,;6.87,-3.24,;4.43,-1.99,)|
Show InChI InChI=1S/C18H24F3N3O3S/c19-12-3-6-16(15(21)9-12)28(26,27)23-14-4-1-11(2-5-14)17(22)18(25)24-8-7-13(20)10-24/h3,6,9,11,13-14,17,23H,1-2,4-5,7-8,10,22H2/t11-,13-,14-,17-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11500
PNG
((2S,3S)-3-[4-(3-carboxyphenyl)phenyl]-1-[(3S)-3-fl...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1cccc(c1)C(O)=O |r|
Show InChI InChI=1S/C21H23FN2O3/c1-13(19(23)20(25)24-10-9-18(22)12-24)14-5-7-15(8-6-14)16-3-2-4-17(11-16)21(26)27/h2-8,11,13,18-19H,9-10,12,23H2,1H3,(H,26,27)/p+1/t13-,18-,19-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11515
PNG
((2S,3S)-3-[4-(3,4-difluorophenyl)phenyl]-1-[(3S)-3...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1ccc(F)c(F)c1 |r|
Show InChI InChI=1S/C20H21F3N2O/c1-12(19(24)20(26)25-9-8-16(21)11-25)13-2-4-14(5-3-13)15-6-7-17(22)18(23)10-15/h2-7,10,12,16,19H,8-9,11,24H2,1H3/p+1/t12-,16-,19-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11189
PNG
((2S,3S)-3-[4-(4-fluorophenyl)phenyl]-1-[(3S)-3-flu...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1ccc(F)cc1 |r|
Show InChI InChI=1S/C20H22F2N2O/c1-13(19(23)20(25)24-11-10-18(22)12-24)14-2-4-15(5-3-14)16-6-8-17(21)9-7-16/h2-9,13,18-19H,10-12,23H2,1H3/p+1/t13-,18-,19-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11518
PNG
((2S,3S)-1-[(3S)-3-fluoropyrrolidin-1-yl]-3-{4-[3-(...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1cccc(c1)-c1nnco1 |r|
Show InChI InChI=1S/C22H23FN4O2/c1-14(20(24)22(28)27-10-9-19(23)12-27)15-5-7-16(8-6-15)17-3-2-4-18(11-17)21-26-25-13-29-21/h2-8,11,13-14,19-20H,9-10,12,24H2,1H3/p+1/t14-,19-,20-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11498
PNG
((2S,3S)-3-{4-[3-(ethoxycarbonyl)phenyl]phenyl}-1-[...)
Show SMILES CCOC(=O)c1cccc(c1)-c1ccc(cc1)[C@H](C)[C@H]([NH3+])C(=O)N1CC[C@H](F)C1 |r|
Show InChI InChI=1S/C23H27FN2O3/c1-3-29-23(28)19-6-4-5-18(13-19)17-9-7-16(8-10-17)15(2)21(25)22(27)26-12-11-20(24)14-26/h4-10,13,15,20-21H,3,11-12,14,25H2,1-2H3/p+1/t15-,20-,21-/m0/s1
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Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11494
PNG
((2S,3S)-3-[4-(2-chlorophenyl)phenyl]-1-[(3S)-3-flu...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1ccccc1Cl |r|
Show InChI InChI=1S/C20H22ClFN2O/c1-13(19(23)20(25)24-11-10-16(22)12-24)14-6-8-15(9-7-14)17-4-2-3-5-18(17)21/h2-9,13,16,19H,10-12,23H2,1H3/p+1/t13-,16-,19-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11519
PNG
((2S,3S)-1-[(3S)-3-fluoropyrrolidin-1-yl]-1-oxo-3-{...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1cccc(c1)-c1n[nH]c(=O)[nH]1 |r|
Show InChI InChI=1S/C22H24FN5O2/c1-13(19(24)21(29)28-10-9-18(23)12-28)14-5-7-15(8-6-14)16-3-2-4-17(11-16)20-25-22(30)27-26-20/h2-8,11,13,18-19H,9-10,12,24H2,1H3,(H2,25,26,27,30)/p+1/t13-,18-,19-/m0/s1
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Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM11522
PNG
((2S,3S)-3-{4-[3-(5-cyclopropyl-1,2,4-oxadiazol-3-y...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1cccc(c1)-c1noc(n1)C1CC1 |r|
Show InChI InChI=1S/C25H27FN4O2/c1-15(22(27)25(31)30-12-11-21(26)14-30)16-5-7-17(8-6-16)19-3-2-4-20(13-19)23-28-24(32-29-23)18-9-10-18/h2-8,13,15,18,21-22H,9-12,14,27H2,1H3/p+1/t15-,21-,22-/m0/s1
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Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11521
PNG
((2S,3S)-1-[(3S)-3-fluoropyrrolidin-1-yl]-1-oxo-3-{...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1cccc(c1)-c1nnc[nH]1 |r|
Show InChI InChI=1S/C22H24FN5O/c1-14(20(24)22(29)28-10-9-19(23)12-28)15-5-7-16(8-6-15)17-3-2-4-18(11-17)21-25-13-26-27-21/h2-8,11,13-14,19-20H,9-10,12,24H2,1H3,(H,25,26,27)/p+1/t14-,19-,20-/m0/s1
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Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11504
PNG
((2S,3S)-3-[4-(3-carbamoylphenyl)phenyl]-1-[(3S)-3-...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1cccc(c1)C(N)=O |r|
Show InChI InChI=1S/C21H24FN3O2/c1-13(19(23)21(27)25-10-9-18(22)12-25)14-5-7-15(8-6-14)16-3-2-4-17(11-16)20(24)26/h2-8,11,13,18-19H,9-10,12,23H2,1H3,(H2,24,26)/p+1/t13-,18-,19-/m0/s1
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Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11493
PNG
((2S,3S)-3-[4-(2-fluorophenyl)phenyl]-1-[(3S)-3-flu...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1ccccc1F |r|
Show InChI InChI=1S/C20H22F2N2O/c1-13(19(23)20(25)24-11-10-16(21)12-24)14-6-8-15(9-7-14)17-4-2-3-5-18(17)22/h2-9,13,16,19H,10-12,23H2,1H3/p+1/t13-,16-,19-/m0/s1
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Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11490
PNG
((2S,3S)-1-[(3S)-3-fluoropyrrolidin-1-yl]-1-oxo-3-[...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1cccnc1 |r|
Show InChI InChI=1S/C19H22FN3O/c1-13(18(21)19(24)23-10-8-17(20)12-23)14-4-6-15(7-5-14)16-3-2-9-22-11-16/h2-7,9,11,13,17-18H,8,10,12,21H2,1H3/p+1/t13-,17-,18-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11495
PNG
((2S,3S)-1-[(3S)-3-fluoropyrrolidin-1-yl]-3-[4-(2-m...)
Show SMILES COc1ccccc1-c1ccc(cc1)[C@H](C)[C@H]([NH3+])C(=O)N1CC[C@H](F)C1 |r|
Show InChI InChI=1S/C21H25FN2O2/c1-14(20(23)21(25)24-12-11-17(22)13-24)15-7-9-16(10-8-15)18-5-3-4-6-19(18)26-2/h3-10,14,17,20H,11-13,23H2,1-2H3/p+1/t14-,17-,20-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11501
PNG
((2S,3S)-1-[(3S)-3-fluoropyrrolidin-1-yl]-3-[4-(3-m...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1cccc(c1)S(C)(=O)=O |r|
Show InChI InChI=1S/C21H25FN2O3S/c1-14(20(23)21(25)24-11-10-18(22)13-24)15-6-8-16(9-7-15)17-4-3-5-19(12-17)28(2,26)27/h3-9,12,14,18,20H,10-11,13,23H2,1-2H3/p+1/t14-,18-,20-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11491
PNG
((2S,3S)-1-[(3S)-3-fluoropyrrolidin-1-yl]-1-oxo-3-[...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1ccncc1 |r|
Show InChI InChI=1S/C19H22FN3O/c1-13(18(21)19(24)23-11-8-17(20)12-23)14-2-4-15(5-3-14)16-6-9-22-10-7-16/h2-7,9-10,13,17-18H,8,11-12,21H2,1H3/p+1/t13-,17-,18-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11520
PNG
((2S,3S)-1-[(3S)-3-fluoropyrrolidin-1-yl]-1-oxo-3-{...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1cccc(c1)-c1c[nH]c(=O)[nH]1 |r|
Show InChI InChI=1S/C23H25FN4O2/c1-14(21(25)22(29)28-10-9-19(24)13-28)15-5-7-16(8-6-15)17-3-2-4-18(11-17)20-12-26-23(30)27-20/h2-8,11-12,14,19,21H,9-10,13,25H2,1H3,(H2,26,27,30)/p+1/t14-,19-,21-/m0/s1
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Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11484
PNG
((2S,3S)-1-[(3S)-3-fluoropyrrolidin-1-yl]-1-oxo-3-(...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1ccccc1 |r|
Show InChI InChI=1S/C20H23FN2O/c1-14(19(22)20(24)23-12-11-18(21)13-23)15-7-9-17(10-8-15)16-5-3-2-4-6-16/h2-10,14,18-19H,11-13,22H2,1H3/p+1/t14-,18-,19-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM11510
PNG
((2S,3S)-3-{4-[4-(ethoxycarbonyl)phenyl]phenyl}-1-[...)
Show SMILES CCOC(=O)c1ccc(cc1)-c1ccc(cc1)[C@H](C)[C@H]([NH3+])C(=O)N1CC[C@H](F)C1 |r|
Show InChI InChI=1S/C23H27FN2O3/c1-3-29-23(28)19-10-8-18(9-11-19)17-6-4-16(5-7-17)15(2)21(25)22(27)26-13-12-20(24)14-26/h4-11,15,20-21H,3,12-14,25H2,1-2H3/p+1/t15-,20-,21-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11507
PNG
((2S,3S)-1-[(3S)-3-fluoropyrrolidin-1-yl]-3-[4-(4-m...)
Show SMILES COc1ccc(cc1)-c1ccc(cc1)[C@H](C)[C@H]([NH3+])C(=O)N1CC[C@H](F)C1 |r|
Show InChI InChI=1S/C21H25FN2O2/c1-14(20(23)21(25)24-12-11-18(22)13-24)15-3-5-16(6-4-15)17-7-9-19(26-2)10-8-17/h3-10,14,18,20H,11-13,23H2,1-2H3/p+1/t14-,18-,20-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11496
PNG
((2S,3S)-1-[(3S)-3-fluoropyrrolidin-1-yl]-1-oxo-3-{...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1ccccc1C(F)(F)F |r|
Show InChI InChI=1S/C21H22F4N2O/c1-13(19(26)20(28)27-11-10-16(22)12-27)14-6-8-15(9-7-14)17-4-2-3-5-18(17)21(23,24)25/h2-9,13,16,19H,10-12,26H2,1H3/p+1/t13-,16-,19-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11517
PNG
((2S,3S)-1-[(3S)-3-fluoropyrrolidin-1-yl]-1-oxo-3-{...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1cccc(c1)-n1cnnn1 |r|
Show InChI InChI=1S/C21H23FN6O/c1-14(20(23)21(29)27-10-9-18(22)12-27)15-5-7-16(8-6-15)17-3-2-4-19(11-17)28-13-24-25-26-28/h2-8,11,13-14,18,20H,9-10,12,23H2,1H3/p+1/t14-,18-,20-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11522
PNG
((2S,3S)-3-{4-[3-(5-cyclopropyl-1,2,4-oxadiazol-3-y...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1cccc(c1)-c1noc(n1)C1CC1 |r|
Show InChI InChI=1S/C25H27FN4O2/c1-15(22(27)25(31)30-12-11-21(26)14-30)16-5-7-17(8-6-16)19-3-2-4-20(13-19)23-28-24(32-29-23)18-9-10-18/h2-8,13,15,18,21-22H,9-12,14,27H2,1H3/p+1/t15-,21-,22-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11502
PNG
((2S,3S)-1-[(3S)-3-fluoropyrrolidin-1-yl]-1-oxo-3-[...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1cccc(c1)S(N)(=O)=O |r|
Show InChI InChI=1S/C20H24FN3O3S/c1-13(19(22)20(25)24-10-9-17(21)12-24)14-5-7-15(8-6-14)16-3-2-4-18(11-16)28(23,26)27/h2-8,11,13,17,19H,9-10,12,22H2,1H3,(H2,23,26,27)/p+1/t13-,17-,19-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11514
PNG
((2S,3S)-3-[4-(2,5-difluorophenyl)phenyl]-1-[(3S)-3...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1cc(F)ccc1F |r|
Show InChI InChI=1S/C20H21F3N2O/c1-12(19(24)20(26)25-9-8-16(22)11-25)13-2-4-14(5-3-13)17-10-15(21)6-7-18(17)23/h2-7,10,12,16,19H,8-9,11,24H2,1H3/p+1/t12-,16-,19-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11499
PNG
((2S,3S)-1-[(3S)-3-fluoropyrrolidin-1-yl]-3-[4-(3-m...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1cccc(NS(C)(=O)=O)c1 |r|
Show InChI InChI=1S/C21H26FN3O3S/c1-14(20(23)21(26)25-11-10-18(22)13-25)15-6-8-16(9-7-15)17-4-3-5-19(12-17)24-29(2,27)28/h3-9,12,14,18,20,24H,10-11,13,23H2,1-2H3/p+1/t14-,18-,20-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11497
PNG
((2S,3S)-1-[(3S)-3-fluoropyrrolidin-1-yl]-3-[4-(2-m...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1ccccc1C |r|
Show InChI InChI=1S/C21H25FN2O/c1-14-5-3-4-6-19(14)17-9-7-16(8-10-17)15(2)20(23)21(25)24-12-11-18(22)13-24/h3-10,15,18,20H,11-13,23H2,1-2H3/p+1/t15-,18-,20-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11479
PNG
((2S,3S)-3-(4-chlorophenyl)-1-[(3S)-3-fluoropyrroli...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(Cl)cc1 |r|
Show InChI InChI=1S/C14H18ClFN2O/c1-9(10-2-4-11(15)5-3-10)13(17)14(19)18-7-6-12(16)8-18/h2-5,9,12-13H,6-8,17H2,1H3/p+1/t9-,12-,13-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM11465
PNG
((2S,3R)-2-amino-3-methyl-1-(1,3-thiazolidin-3-yl)p...)
Show SMILES CC[C@@H](C)[C@H](N)C(=O)N1CCSC1 |r|
Show InChI InChI=1S/C9H18N2OS/c1-3-7(2)8(10)9(12)11-4-5-13-6-11/h7-8H,3-6,10H2,1-2H3/t7-,8+/m1/s1
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Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11489
PNG
((2S,3S)-1-[(3S)-3-fluoropyrrolidin-1-yl]-1-oxo-3-[...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1ccccn1 |r|
Show InChI InChI=1S/C19H22FN3O/c1-13(18(21)19(24)23-11-9-16(20)12-23)14-5-7-15(8-6-14)17-4-2-3-10-22-17/h2-8,10,13,16,18H,9,11-12,21H2,1H3/p+1/t13-,16-,18-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11513
PNG
((2S,3S)-3-[4-(3,5-difluorophenyl)phenyl]-1-[(3S)-3...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1cc(F)cc(F)c1 |r|
Show InChI InChI=1S/C20H21F3N2O/c1-12(19(24)20(26)25-7-6-16(21)11-25)13-2-4-14(5-3-13)15-8-17(22)10-18(23)9-15/h2-5,8-10,12,16,19H,6-7,11,24H2,1H3/p+1/t12-,16-,19-/m0/s1
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Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM11499
PNG
((2S,3S)-1-[(3S)-3-fluoropyrrolidin-1-yl]-3-[4-(3-m...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1cccc(NS(C)(=O)=O)c1 |r|
Show InChI InChI=1S/C21H26FN3O3S/c1-14(20(23)21(26)25-11-10-18(22)13-25)15-6-8-16(9-7-15)17-4-3-5-19(12-17)24-29(2,27)28/h3-9,12,14,18,20,24H,10-11,13,23H2,1-2H3/p+1/t14-,18-,20-/m0/s1
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Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11478
PNG
((2S,3S)-3-(4-bromophenyl)-1-[(3S)-3-fluoropyrrolid...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(Br)cc1 |r|
Show InChI InChI=1S/C14H18BrFN2O/c1-9(10-2-4-11(15)5-3-10)13(17)14(19)18-7-6-12(16)8-18/h2-5,9,12-13H,6-8,17H2,1H3/p+1/t9-,12-,13-/m0/s1
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Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11477
PNG
((2S,3S)-3-(4-fluorophenyl)-1-[(3S)-3-fluoropyrroli...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(F)cc1 |r|
Show InChI InChI=1S/C14H18F2N2O/c1-9(10-2-4-11(15)5-3-10)13(17)14(19)18-7-6-12(16)8-18/h2-5,9,12-13H,6-8,17H2,1H3/p+1/t9-,12-,13-/m0/s1
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Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM11465
PNG
((2S,3R)-2-amino-3-methyl-1-(1,3-thiazolidin-3-yl)p...)
Show SMILES CC[C@@H](C)[C@H](N)C(=O)N1CCSC1 |r|
Show InChI InChI=1S/C9H18N2OS/c1-3-7(2)8(10)9(12)11-4-5-13-6-11/h7-8H,3-6,10H2,1-2H3/t7-,8+/m1/s1
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Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM11507
PNG
((2S,3S)-1-[(3S)-3-fluoropyrrolidin-1-yl]-3-[4-(4-m...)
Show SMILES COc1ccc(cc1)-c1ccc(cc1)[C@H](C)[C@H]([NH3+])C(=O)N1CC[C@H](F)C1 |r|
Show InChI InChI=1S/C21H25FN2O2/c1-14(20(23)21(25)24-12-11-18(22)13-24)15-3-5-16(6-4-15)17-7-9-19(26-2)10-8-17/h3-10,14,18,20H,11-13,23H2,1-2H3/p+1/t14-,18-,20-/m0/s1
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Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM11521
PNG
((2S,3S)-1-[(3S)-3-fluoropyrrolidin-1-yl]-1-oxo-3-{...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1cccc(c1)-c1nnc[nH]1 |r|
Show InChI InChI=1S/C22H24FN5O/c1-14(20(24)22(29)28-10-9-19(23)12-28)15-5-7-16(8-6-15)17-3-2-4-18(11-17)21-25-13-26-27-21/h2-8,11,13-14,19-20H,9-10,12,24H2,1H3,(H,25,26,27)/p+1/t14-,19-,20-/m0/s1
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Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11480
PNG
((2S,3S)-1-[(3S)-3-fluoropyrrolidin-1-yl]-3-[4-(met...)
Show SMILES CSc1ccc(cc1)[C@H](C)[C@H]([NH3+])C(=O)N1CC[C@H](F)C1 |r|
Show InChI InChI=1S/C15H21FN2OS/c1-10(11-3-5-13(20-2)6-4-11)14(17)15(19)18-8-7-12(16)9-18/h3-6,10,12,14H,7-9,17H2,1-2H3/p+1/t10-,12-,14-/m0/s1
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Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11511
PNG
((2S,3S)-3-[4-(4-carboxyphenyl)phenyl]-1-[(3S)-3-fl...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C21H23FN2O3/c1-13(19(23)20(25)24-11-10-18(22)12-24)14-2-4-15(5-3-14)16-6-8-17(9-7-16)21(26)27/h2-9,13,18-19H,10-12,23H2,1H3,(H,26,27)/p+1/t13-,18-,19-/m0/s1
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Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM11494
PNG
((2S,3S)-3-[4-(2-chlorophenyl)phenyl]-1-[(3S)-3-flu...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1ccccc1Cl |r|
Show InChI InChI=1S/C20H22ClFN2O/c1-13(19(23)20(25)24-11-10-16(22)12-24)14-6-8-15(9-7-14)17-4-2-3-5-18(17)21/h2-9,13,16,19H,10-12,23H2,1H3/p+1/t13-,16-,19-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11508
PNG
((2S,3S)-1-[(3S)-3-fluoropyrrolidin-1-yl]-3-[4-(4-m...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1ccc(C)cc1 |r|
Show InChI InChI=1S/C21H25FN2O/c1-14-3-5-17(6-4-14)18-9-7-16(8-10-18)15(2)20(23)21(25)24-12-11-19(22)13-24/h3-10,15,19-20H,11-13,23H2,1-2H3/p+1/t15-,19-,20-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11464
PNG
((2S,3S)-2-amino-3-methyl-1-(1,3-thiazolidin-3-yl)p...)
Show SMILES CC[C@H](C)[C@H](N)C(=O)N1CCSC1 |r|
Show InChI InChI=1S/C9H18N2OS/c1-3-7(2)8(10)9(12)11-4-5-13-6-11/h7-8H,3-6,10H2,1-2H3/t7-,8-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11512
PNG
((2S,3S)-1-[(3S)-3-fluoropyrrolidin-1-yl]-3-[4-(4-m...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(cc1)-c1ccc(cc1)S(C)(=O)=O |r|
Show InChI InChI=1S/C21H25FN2O3S/c1-14(20(23)21(25)24-12-11-18(22)13-24)15-3-5-16(6-4-15)17-7-9-19(10-8-17)28(2,26)27/h3-10,14,18,20H,11-13,23H2,1-2H3/p+1/t14-,18-,20-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11510
PNG
((2S,3S)-3-{4-[4-(ethoxycarbonyl)phenyl]phenyl}-1-[...)
Show SMILES CCOC(=O)c1ccc(cc1)-c1ccc(cc1)[C@H](C)[C@H]([NH3+])C(=O)N1CC[C@H](F)C1 |r|
Show InChI InChI=1S/C23H27FN2O3/c1-3-29-23(28)19-10-8-18(9-11-19)17-6-4-16(5-7-17)15(2)21(25)22(27)26-13-12-20(24)14-26/h4-11,15,20-21H,3,12-14,25H2,1-2H3/p+1/t15-,20-,21-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11465
PNG
((2S,3R)-2-amino-3-methyl-1-(1,3-thiazolidin-3-yl)p...)
Show SMILES CC[C@@H](C)[C@H](N)C(=O)N1CCSC1 |r|
Show InChI InChI=1S/C9H18N2OS/c1-3-7(2)8(10)9(12)11-4-5-13-6-11/h7-8H,3-6,10H2,1-2H3/t7-,8+/m1/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11469
PNG
((2S,3S)-3-(4-chloro-2-fluorophenyl)-1-[(3S)-3-fluo...)
Show SMILES C[C@H]([C@H]([NH3+])C(=O)N1CC[C@H](F)C1)c1ccc(Cl)cc1F |r|
Show InChI InChI=1S/C14H17ClF2N2O/c1-8(11-3-2-9(15)6-12(11)17)13(18)14(20)19-5-4-10(16)7-19/h2-3,6,8,10,13H,4-5,7,18H2,1H3/p+1/t8-,10-,13-/m0/s1
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Merck Research Laboratories



Assay Description
The enzyme activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 360 nm and m...


Bioorg Med Chem Lett 15: 2533-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.055
BindingDB Entry DOI: 10.7270/Q2K935SH
More data for this
Ligand-Target Pair
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* indicates data uncertainty>20%