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8 similar compounds to monomer 11719

Compile data set for download or QSAR
Wt: 326.3
BDBM11700
Wt: 368.4
BDBM11716
Wt: 370.4
BDBM11720
Wt: 338.4
BDBM12178
Wt: 366.4
BDBM12179
Wt: 342.4
BDBM50201585
Wt: 352.4
BDBM50205213
Wt: 312.3
BDBM50257316

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 29 hits for monomerid = 11700,11716,11720,12178,12179,50201585,50205213,50257316   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM12178
PNG
((2S)-1-{[(2S,4S)-4-(2,3-dihydro-1H-isoindol-2-ylca...)
Show SMILES O=C([C@@H]1CN[C@@H](C1)C(=O)N1CCC[C@H]1C#N)N1Cc2ccccc2C1
Show InChI InChI=1S/C19H22N4O2/c20-9-16-6-3-7-23(16)19(25)17-8-15(10-21-17)18(24)22-11-13-4-1-2-5-14(13)12-22/h1-2,4-5,15-17,21H,3,6-8,10-12H2/t15-,16-,17-/m0/s1
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Assay Description
The enzyme activity resulted in the liberation of free pNA at 405 nm. Reaction progress was monitored using a Molecular Devices SpectraMax Plus micro...


Bioorg Med Chem Lett 16: 3268-72 (2006)


Article DOI: 10.1016/j.bmcl.2006.03.037
BindingDB Entry DOI: 10.7270/Q22805V8
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50257316
PNG
((S)-1-((S)-2-amino-4-(isoindolin-2-yl)-4-oxobutano...)
Show SMILES N[C@@H](CC(=O)N1Cc2ccccc2C1)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C17H20N4O2/c18-9-14-6-3-7-21(14)17(23)15(19)8-16(22)20-10-12-4-1-2-5-13(12)11-20/h1-2,4-5,14-15H,3,6-8,10-11,19H2/t14-,15-/m0/s1
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Curated by ChEMBL


Assay Description
Inhibition of DPP2 (unknown origin)


Bioorg Med Chem Lett 19: 1908-12 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.061
BindingDB Entry DOI: 10.7270/Q2348K74
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM12178
PNG
((2S)-1-{[(2S,4S)-4-(2,3-dihydro-1H-isoindol-2-ylca...)
Show SMILES O=C([C@@H]1CN[C@@H](C1)C(=O)N1CCC[C@H]1C#N)N1Cc2ccccc2C1
Show InChI InChI=1S/C19H22N4O2/c20-9-16-6-3-7-23(16)19(25)17-8-15(10-21-17)18(24)22-11-13-4-1-2-5-14(13)12-22/h1-2,4-5,15-17,21H,3,6-8,10-12H2/t15-,16-,17-/m0/s1
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n/an/a 2.73E+3n/an/an/an/an/an/a



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Assay Description
The enzyme activity resulted in the liberation of free pNA at 405 nm. Reaction progress was monitored using a Molecular Devices SpectraMax Plus micro...


Bioorg Med Chem Lett 16: 3268-72 (2006)


Article DOI: 10.1016/j.bmcl.2006.03.037
BindingDB Entry DOI: 10.7270/Q22805V8
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM12179
PNG
((2S)-1-{[(2S,4S)-4-(2,3-dihydro-1H-isoindol-2-ylca...)
Show SMILES CC1(C)N[C@@H](C[C@@H]1C(=O)N1Cc2ccccc2C1)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C21H26N4O2/c1-21(2)17(19(26)24-12-14-6-3-4-7-15(14)13-24)10-18(23-21)20(27)25-9-5-8-16(25)11-22/h3-4,6-7,16-18,23H,5,8-10,12-13H2,1-2H3/t16-,17+,18-/m0/s1
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Assay Description
The enzyme activity resulted in the liberation of free pNA at 405 nm. Reaction progress was monitored using a Molecular Devices SpectraMax Plus micro...


Bioorg Med Chem Lett 16: 3268-72 (2006)


Article DOI: 10.1016/j.bmcl.2006.03.037
BindingDB Entry DOI: 10.7270/Q22805V8
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM12178
PNG
((2S)-1-{[(2S,4S)-4-(2,3-dihydro-1H-isoindol-2-ylca...)
Show SMILES O=C([C@@H]1CN[C@@H](C1)C(=O)N1CCC[C@H]1C#N)N1Cc2ccccc2C1
Show InChI InChI=1S/C19H22N4O2/c20-9-16-6-3-7-23(16)19(25)17-8-15(10-21-17)18(24)22-11-13-4-1-2-5-14(13)12-22/h1-2,4-5,15-17,21H,3,6-8,10-12H2/t15-,16-,17-/m0/s1
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Assay Description
The enzyme activity resulted in the liberation of free pNA at 405 nm. Reaction progress was monitored using a Molecular Devices SpectraMax Plus micro...


Bioorg Med Chem Lett 16: 3268-72 (2006)


Article DOI: 10.1016/j.bmcl.2006.03.037
BindingDB Entry DOI: 10.7270/Q22805V8
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM12179
PNG
((2S)-1-{[(2S,4S)-4-(2,3-dihydro-1H-isoindol-2-ylca...)
Show SMILES CC1(C)N[C@@H](C[C@@H]1C(=O)N1Cc2ccccc2C1)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C21H26N4O2/c1-21(2)17(19(26)24-12-14-6-3-4-7-15(14)13-24)10-18(23-21)20(27)25-9-5-8-16(25)11-22/h3-4,6-7,16-18,23H,5,8-10,12-13H2,1-2H3/t16-,17+,18-/m0/s1
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Assay Description
The enzyme activity resulted in the liberation of free pNA at 405 nm. Reaction progress was monitored using a Molecular Devices SpectraMax Plus micro...


Bioorg Med Chem Lett 16: 3268-72 (2006)


Article DOI: 10.1016/j.bmcl.2006.03.037
BindingDB Entry DOI: 10.7270/Q22805V8
More data for this
Ligand-Target Pair
Fibroblast Activation Protein (FAP)


(Homo sapiens (Human))
BDBM12178
PNG
((2S)-1-{[(2S,4S)-4-(2,3-dihydro-1H-isoindol-2-ylca...)
Show SMILES O=C([C@@H]1CN[C@@H](C1)C(=O)N1CCC[C@H]1C#N)N1Cc2ccccc2C1
Show InChI InChI=1S/C19H22N4O2/c20-9-16-6-3-7-23(16)19(25)17-8-15(10-21-17)18(24)22-11-13-4-1-2-5-14(13)12-22/h1-2,4-5,15-17,21H,3,6-8,10-12H2/t15-,16-,17-/m0/s1
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n/an/a 175n/an/an/an/an/an/a



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Assay Description
The enzyme activity resulted in the liberation of free pNA at 405 nm. Reaction progress was monitored using a Molecular Devices SpectraMax Plus micro...


Bioorg Med Chem Lett 16: 3268-72 (2006)


Article DOI: 10.1016/j.bmcl.2006.03.037
BindingDB Entry DOI: 10.7270/Q22805V8
More data for this
Ligand-Target Pair
Fibroblast Activation Protein (FAP)


(Homo sapiens (Human))
BDBM12179
PNG
((2S)-1-{[(2S,4S)-4-(2,3-dihydro-1H-isoindol-2-ylca...)
Show SMILES CC1(C)N[C@@H](C[C@@H]1C(=O)N1Cc2ccccc2C1)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C21H26N4O2/c1-21(2)17(19(26)24-12-14-6-3-4-7-15(14)13-24)10-18(23-21)20(27)25-9-5-8-16(25)11-22/h3-4,6-7,16-18,23H,5,8-10,12-13H2,1-2H3/t16-,17+,18-/m0/s1
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Assay Description
The enzyme activity resulted in the liberation of free pNA at 405 nm. Reaction progress was monitored using a Molecular Devices SpectraMax Plus micro...


Bioorg Med Chem Lett 16: 3268-72 (2006)


Article DOI: 10.1016/j.bmcl.2006.03.037
BindingDB Entry DOI: 10.7270/Q22805V8
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11700
PNG
((2S)-1-(2-{[3-(2,3-dihydro-1H-isoindol-2-yl)-3-oxo...)
Show SMILES O=C(CCNCC(=O)N1CCC[C@H]1C#N)N1Cc2ccccc2C1
Show InChI InChI=1S/C18H22N4O2/c19-10-16-6-3-9-22(16)18(24)11-20-8-7-17(23)21-12-14-4-1-2-5-15(14)13-21/h1-2,4-5,16,20H,3,6-9,11-13H2/t16-/m0/s1
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n/an/a 132n/an/an/an/a8.037



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Assay Description
The enzyme activity resulted in the liberation of free pNA at 405 nm. Reaction progress was monitored using a Molecular Devices SpectraMax Plus micro...


J Med Chem 49: 373-80 (2006)


Article DOI: 10.1021/jm0507781
BindingDB Entry DOI: 10.7270/Q28W3BJH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11716
PNG
((2S)-1-(2-{[2-methyl-4-oxo-4-(1,2,3,4-tetrahydrois...)
Show SMILES CC(C)(CC(=O)N1CCc2ccccc2C1)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C21H28N4O2/c1-21(2,23-14-20(27)25-10-5-8-18(25)13-22)12-19(26)24-11-9-16-6-3-4-7-17(16)15-24/h3-4,6-7,18,23H,5,8-12,14-15H2,1-2H3/t18-/m0/s1
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n/an/a 49n/an/an/an/an/an/a



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Assay Description
The enzyme activity resulted in the liberation of free pNA at 405 nm. Reaction progress was monitored using a Molecular Devices SpectraMax Plus micro...


J Med Chem 49: 373-80 (2006)


Article DOI: 10.1021/jm0507781
BindingDB Entry DOI: 10.7270/Q28W3BJH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11720
PNG
((2S)-Cyanopyrrolidine analogue 21e | 3-({2-[(2S)-2...)
Show SMILES CC(C)(CC(=O)NC(C)(C)c1ccccc1)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C21H30N4O2/c1-20(2,23-15-19(27)25-12-8-11-17(25)14-22)13-18(26)24-21(3,4)16-9-6-5-7-10-16/h5-7,9-10,17,23H,8,11-13,15H2,1-4H3,(H,24,26)/t17-/m0/s1
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n/an/a 1.11E+3n/an/an/an/an/an/a



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Assay Description
The enzyme activity resulted in the liberation of free pNA at 405 nm. Reaction progress was monitored using a Molecular Devices SpectraMax Plus micro...


J Med Chem 49: 373-80 (2006)


Article DOI: 10.1021/jm0507781
BindingDB Entry DOI: 10.7270/Q28W3BJH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM11700
PNG
((2S)-1-(2-{[3-(2,3-dihydro-1H-isoindol-2-yl)-3-oxo...)
Show SMILES O=C(CCNCC(=O)N1CCC[C@H]1C#N)N1Cc2ccccc2C1
Show InChI InChI=1S/C18H22N4O2/c19-10-16-6-3-9-22(16)18(24)11-20-8-7-17(23)21-12-14-4-1-2-5-15(14)13-21/h1-2,4-5,16,20H,3,6-9,11-13H2/t16-/m0/s1
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n/an/a 2.12E+3n/an/an/an/an/an/a



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Assay Description
The enzyme activity resulted in the liberation of free pNA at 405 nm. Reaction progress was monitored using a Molecular Devices SpectraMax Plus micro...


J Med Chem 49: 373-80 (2006)


Article DOI: 10.1021/jm0507781
BindingDB Entry DOI: 10.7270/Q28W3BJH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM11716
PNG
((2S)-1-(2-{[2-methyl-4-oxo-4-(1,2,3,4-tetrahydrois...)
Show SMILES CC(C)(CC(=O)N1CCc2ccccc2C1)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C21H28N4O2/c1-21(2,23-14-20(27)25-10-5-8-18(25)13-22)12-19(26)24-11-9-16-6-3-4-7-17(16)15-24/h3-4,6-7,18,23H,5,8-12,14-15H2,1-2H3/t18-/m0/s1
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Assay Description
The enzyme activity resulted in the liberation of free pNA at 405 nm. Reaction progress was monitored using a Molecular Devices SpectraMax Plus micro...


J Med Chem 49: 373-80 (2006)


Article DOI: 10.1021/jm0507781
BindingDB Entry DOI: 10.7270/Q28W3BJH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM11720
PNG
((2S)-Cyanopyrrolidine analogue 21e | 3-({2-[(2S)-2...)
Show SMILES CC(C)(CC(=O)NC(C)(C)c1ccccc1)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C21H30N4O2/c1-20(2,23-15-19(27)25-12-8-11-17(25)14-22)13-18(26)24-21(3,4)16-9-6-5-7-10-16/h5-7,9-10,17,23H,8,11-13,15H2,1-4H3,(H,24,26)/t17-/m0/s1
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Assay Description
The enzyme activity resulted in the liberation of free pNA at 405 nm. Reaction progress was monitored using a Molecular Devices SpectraMax Plus micro...


J Med Chem 49: 373-80 (2006)


Article DOI: 10.1021/jm0507781
BindingDB Entry DOI: 10.7270/Q28W3BJH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM11700
PNG
((2S)-1-(2-{[3-(2,3-dihydro-1H-isoindol-2-yl)-3-oxo...)
Show SMILES O=C(CCNCC(=O)N1CCC[C@H]1C#N)N1Cc2ccccc2C1
Show InChI InChI=1S/C18H22N4O2/c19-10-16-6-3-9-22(16)18(24)11-20-8-7-17(23)21-12-14-4-1-2-5-15(14)13-21/h1-2,4-5,16,20H,3,6-9,11-13H2/t16-/m0/s1
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Assay Description
The enzyme activity resulted in the liberation of free pNA at 405 nm. Reaction progress was monitored using a Molecular Devices SpectraMax Plus micro...


J Med Chem 49: 373-80 (2006)


Article DOI: 10.1021/jm0507781
BindingDB Entry DOI: 10.7270/Q28W3BJH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM11716
PNG
((2S)-1-(2-{[2-methyl-4-oxo-4-(1,2,3,4-tetrahydrois...)
Show SMILES CC(C)(CC(=O)N1CCc2ccccc2C1)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C21H28N4O2/c1-21(2,23-14-20(27)25-10-5-8-18(25)13-22)12-19(26)24-11-9-16-6-3-4-7-17(16)15-24/h3-4,6-7,18,23H,5,8-12,14-15H2,1-2H3/t18-/m0/s1
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n/an/a 3.42E+4n/an/an/an/an/an/a



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Assay Description
The enzyme activity resulted in the liberation of free pNA at 405 nm. Reaction progress was monitored using a Molecular Devices SpectraMax Plus micro...


J Med Chem 49: 373-80 (2006)


Article DOI: 10.1021/jm0507781
BindingDB Entry DOI: 10.7270/Q28W3BJH
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM11720
PNG
((2S)-Cyanopyrrolidine analogue 21e | 3-({2-[(2S)-2...)
Show SMILES CC(C)(CC(=O)NC(C)(C)c1ccccc1)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C21H30N4O2/c1-20(2,23-15-19(27)25-12-8-11-17(25)14-22)13-18(26)24-21(3,4)16-9-6-5-7-10-16/h5-7,9-10,17,23H,8,11-13,15H2,1-4H3,(H,24,26)/t17-/m0/s1
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Assay Description
The enzyme activity resulted in the liberation of free pNA at 405 nm. Reaction progress was monitored using a Molecular Devices SpectraMax Plus micro...


J Med Chem 49: 373-80 (2006)


Article DOI: 10.1021/jm0507781
BindingDB Entry DOI: 10.7270/Q28W3BJH
More data for this
Ligand-Target Pair
Fibroblast activation protein alpha


(Homo sapiens (Human))
BDBM11720
PNG
((2S)-Cyanopyrrolidine analogue 21e | 3-({2-[(2S)-2...)
Show SMILES CC(C)(CC(=O)NC(C)(C)c1ccccc1)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C21H30N4O2/c1-20(2,23-15-19(27)25-12-8-11-17(25)14-22)13-18(26)24-21(3,4)16-9-6-5-7-10-16/h5-7,9-10,17,23H,8,11-13,15H2,1-4H3,(H,24,26)/t17-/m0/s1
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Curated by ChEMBL


Assay Description
In vitro inhibition of FAP, seprase


Bioorg Med Chem Lett 17: 1274-9 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.019
BindingDB Entry DOI: 10.7270/Q23T9GV7
More data for this
Ligand-Target Pair
Fibroblast activation protein alpha


(Homo sapiens (Human))
BDBM50201585
PNG
((S)-N-benzyl-3-(2-(2-cyanopyrrolidin-1-yl)-2-oxoet...)
Show SMILES CC(C)(CC(=O)NCc1ccccc1)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C19H26N4O2/c1-19(2,11-17(24)21-13-15-7-4-3-5-8-15)22-14-18(25)23-10-6-9-16(23)12-20/h3-5,7-8,16,22H,6,9-11,13-14H2,1-2H3,(H,21,24)/t16-/m0/s1
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n/an/a>2.00E+4n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
In vitro inhibition of FAP, seprase


Bioorg Med Chem Lett 17: 1274-9 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.019
BindingDB Entry DOI: 10.7270/Q23T9GV7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50201585
PNG
((S)-N-benzyl-3-(2-(2-cyanopyrrolidin-1-yl)-2-oxoet...)
Show SMILES CC(C)(CC(=O)NCc1ccccc1)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C19H26N4O2/c1-19(2,11-17(24)21-13-15-7-4-3-5-8-15)22-14-18(25)23-10-6-9-16(23)12-20/h3-5,7-8,16,22H,6,9-11,13-14H2,1-2H3,(H,21,24)/t16-/m0/s1
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n/an/a>2.00E+4n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
In vitro inhibition of DPP-8


Bioorg Med Chem Lett 17: 1274-9 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.019
BindingDB Entry DOI: 10.7270/Q23T9GV7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM11720
PNG
((2S)-Cyanopyrrolidine analogue 21e | 3-({2-[(2S)-2...)
Show SMILES CC(C)(CC(=O)NC(C)(C)c1ccccc1)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C21H30N4O2/c1-20(2,23-15-19(27)25-12-8-11-17(25)14-22)13-18(26)24-21(3,4)16-9-6-5-7-10-16/h5-7,9-10,17,23H,8,11-13,15H2,1-4H3,(H,24,26)/t17-/m0/s1
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n/an/a>2.00E+4n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
In vitro inhibition of DPP-II


Bioorg Med Chem Lett 17: 1274-9 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.019
BindingDB Entry DOI: 10.7270/Q23T9GV7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11720
PNG
((2S)-Cyanopyrrolidine analogue 21e | 3-({2-[(2S)-2...)
Show SMILES CC(C)(CC(=O)NC(C)(C)c1ccccc1)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C21H30N4O2/c1-20(2,23-15-19(27)25-12-8-11-17(25)14-22)13-18(26)24-21(3,4)16-9-6-5-7-10-16/h5-7,9-10,17,23H,8,11-13,15H2,1-4H3,(H,24,26)/t17-/m0/s1
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n/an/a 1.11E+3n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
In vitro inhibition of DPP-4


Bioorg Med Chem Lett 17: 1274-9 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.019
BindingDB Entry DOI: 10.7270/Q23T9GV7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50201585
PNG
((S)-N-benzyl-3-(2-(2-cyanopyrrolidin-1-yl)-2-oxoet...)
Show SMILES CC(C)(CC(=O)NCc1ccccc1)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C19H26N4O2/c1-19(2,11-17(24)21-13-15-7-4-3-5-8-15)22-14-18(25)23-10-6-9-16(23)12-20/h3-5,7-8,16,22H,6,9-11,13-14H2,1-2H3,(H,21,24)/t16-/m0/s1
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n/an/a 239n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
In vitro inhibition of DPP-4


Bioorg Med Chem Lett 17: 1274-9 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.019
BindingDB Entry DOI: 10.7270/Q23T9GV7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM11720
PNG
((2S)-Cyanopyrrolidine analogue 21e | 3-({2-[(2S)-2...)
Show SMILES CC(C)(CC(=O)NC(C)(C)c1ccccc1)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C21H30N4O2/c1-20(2,23-15-19(27)25-12-8-11-17(25)14-22)13-18(26)24-21(3,4)16-9-6-5-7-10-16/h5-7,9-10,17,23H,8,11-13,15H2,1-4H3,(H,24,26)/t17-/m0/s1
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n/an/a>2.00E+4n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
In vitro inhibition of DPP-8


Bioorg Med Chem Lett 17: 1274-9 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.019
BindingDB Entry DOI: 10.7270/Q23T9GV7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50201585
PNG
((S)-N-benzyl-3-(2-(2-cyanopyrrolidin-1-yl)-2-oxoet...)
Show SMILES CC(C)(CC(=O)NCc1ccccc1)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C19H26N4O2/c1-19(2,11-17(24)21-13-15-7-4-3-5-8-15)22-14-18(25)23-10-6-9-16(23)12-20/h3-5,7-8,16,22H,6,9-11,13-14H2,1-2H3,(H,21,24)/t16-/m0/s1
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n/an/a>2.00E+4n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
In vitro inhibition of DPP-II


Bioorg Med Chem Lett 17: 1274-9 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.019
BindingDB Entry DOI: 10.7270/Q23T9GV7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50205213
PNG
(2S)-1-{[(2S,4S,5S)-4-(1,3-dihydro-2H-isoindol-2-yl...)
Show SMILES C[C@@H]1N[C@@H](C[C@@H]1C(=O)N1Cc2ccccc2C1)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C20H24N4O2/c1-13-17(19(25)23-11-14-5-2-3-6-15(14)12-23)9-18(22-13)20(26)24-8-4-7-16(24)10-21/h2-3,5-6,13,16-18,22H,4,7-9,11-12H2,1H3/t13-,16-,17-,18-/m0/s1
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n/an/a 5.60n/an/an/an/an/an/a



Minase Research Institute

Curated by ChEMBL


Assay Description
Inhibition of human DPP4


Bioorg Med Chem 15: 2631-50 (2007)


Article DOI: 10.1016/j.bmc.2007.01.041
BindingDB Entry DOI: 10.7270/Q2CV4HDR
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50257316
PNG
((S)-1-((S)-2-amino-4-(isoindolin-2-yl)-4-oxobutano...)
Show SMILES N[C@@H](CC(=O)N1Cc2ccccc2C1)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C17H20N4O2/c18-9-14-6-3-7-21(14)17(23)15(19)8-16(22)20-10-12-4-1-2-5-13(12)11-20/h1-2,4-5,14-15H,3,6-8,10-11,19H2/t14-,15-/m0/s1
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n/an/a 298n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibition of DPP4 (unknown origin)


Bioorg Med Chem Lett 19: 1908-12 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.061
BindingDB Entry DOI: 10.7270/Q2348K74
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50257316
PNG
((S)-1-((S)-2-amino-4-(isoindolin-2-yl)-4-oxobutano...)
Show SMILES N[C@@H](CC(=O)N1Cc2ccccc2C1)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C17H20N4O2/c18-9-14-6-3-7-21(14)17(23)15(19)8-16(22)20-10-12-4-1-2-5-13(12)11-20/h1-2,4-5,14-15H,3,6-8,10-11,19H2/t14-,15-/m0/s1
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n/an/a 220n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibition of DPP8 (unknown origin)


Bioorg Med Chem Lett 19: 1908-12 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.061
BindingDB Entry DOI: 10.7270/Q2348K74
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM12179
PNG
((2S)-1-{[(2S,4S)-4-(2,3-dihydro-1H-isoindol-2-ylca...)
Show SMILES CC1(C)N[C@@H](C[C@@H]1C(=O)N1Cc2ccccc2C1)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C21H26N4O2/c1-21(2)17(19(26)24-12-14-6-3-4-7-15(14)13-24)10-18(23-21)20(27)25-9-5-8-16(25)11-22/h3-4,6-7,16-18,23H,5,8-10,12-13H2,1-2H3/t16-,17+,18-/m0/s1
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n/an/a 984n/an/an/an/a8.037



National Health Research Institutes



Assay Description
The enzyme activity resulted in the liberation of free pNA at 405 nm. Reaction progress was monitored using a Molecular Devices SpectraMax Plus micro...


Bioorg Med Chem Lett 16: 3268-72 (2006)


Article DOI: 10.1016/j.bmcl.2006.03.037
BindingDB Entry DOI: 10.7270/Q22805V8
More data for this
Ligand-Target Pair