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Compile Data Set for Download or QSAR

Found 139 hits with Last Name = 'chang' and Initial = 'yy'   
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))
BDBM11694
PNG
((2S)-1-[(2S)-2-amino-2-cyclohexylacetyl]pyrrolidin...)
Show SMILES N[C@@H](C1CCCCC1)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C13H21N3O/c14-9-11-7-4-8-16(11)13(17)12(15)10-5-2-1-3-6-10/h10-12H,1-8,15H2/t11-,12-/m0/s1
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n/an/a 12n/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...


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))
BDBM11694
PNG
((2S)-1-[(2S)-2-amino-2-cyclohexylacetyl]pyrrolidin...)
Show SMILES N[C@@H](C1CCCCC1)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C13H21N3O/c14-9-11-7-4-8-16(11)13(17)12(15)10-5-2-1-3-6-10/h10-12H,1-8,15H2/t11-,12-/m0/s1
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n/an/a 12n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase IV [DPP-IV]


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11719
PNG
((2S)-1-(2-{[4-(2,3-dihydro-1H-isoindol-2-yl)-2-met...)
Show SMILES CC(C)(CC(=O)N1Cc2ccccc2C1)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C20H26N4O2/c1-20(2,22-12-19(26)24-9-5-8-17(24)11-21)10-18(25)23-13-15-6-3-4-7-16(15)14-23/h3-4,6-7,17,22H,5,8-10,12-14H2,1-2H3/t17-/m0/s1
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n/an/a 15n/an/an/an/an/an/a



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...


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))
BDBM12183
PNG
((2S)-1-[(2S)-2-amino-4-{4-[bis(4-fluorophenyl)meth...)
Show SMILES N[C@@H](CC(=O)N1CCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C26H29F2N5O2/c27-20-7-3-18(4-8-20)25(19-5-9-21(28)10-6-19)32-14-12-31(13-15-32)24(34)16-23(30)26(35)33-11-1-2-22(33)17-29/h3-10,22-23,25H,1-2,11-16,30H2/t22-,23-/m0/s1
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n/an/a 16n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase 8


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50168268
PNG
((S)-1-[(S)-2-Amino-4-(6,7-dimethoxy-3,4-dihydro-1H...)
Show SMILES COc1cc2CCN(Cc2cc1OC)C(=O)C[C@H](N)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C20H26N4O4/c1-27-17-8-13-5-7-23(12-14(13)9-18(17)28-2)19(25)10-16(22)20(26)24-6-3-4-15(24)11-21/h8-9,15-16H,3-7,10,12,22H2,1-2H3/t15-,16-/m0/s1
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n/an/a 19n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase 8


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11718
PNG
((2S)-1-(2-{[4-(6,8-difluoro-1,2,3,4-tetrahydroisoq...)
Show SMILES CC(C)(CC(=O)N1CCc2cc(F)cc(F)c2C1)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C21H26F2N4O2/c1-21(2,25-12-20(29)27-6-3-4-16(27)11-24)10-19(28)26-7-5-14-8-15(22)9-18(23)17(14)13-26/h8-9,16,25H,3-7,10,12-13H2,1-2H3/t16-/m0/s1
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n/an/a 22n/an/an/an/an/an/a



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...


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))
BDBM11694
PNG
((2S)-1-[(2S)-2-amino-2-cyclohexylacetyl]pyrrolidin...)
Show SMILES N[C@@H](C1CCCCC1)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C13H21N3O/c14-9-11-7-4-8-16(11)13(17)12(15)10-5-2-1-3-6-10/h10-12H,1-8,15H2/t11-,12-/m0/s1
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n/an/a 27n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase 8


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM11694
PNG
((2S)-1-[(2S)-2-amino-2-cyclohexylacetyl]pyrrolidin...)
Show SMILES N[C@@H](C1CCCCC1)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C13H21N3O/c14-9-11-7-4-8-16(11)13(17)12(15)10-5-2-1-3-6-10/h10-12H,1-8,15H2/t11-,12-/m0/s1
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n/an/a 27n/an/an/an/an/an/a



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...


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))
BDBM50168275
PNG
(1-{4-[(S)-3-Amino-4-((S)-2-cyano-pyrrolidin-1-yl)-...)
Show SMILES N[C@@H](CC(=O)N1CCN(CC1)[n+]1cccc(c1)C#N)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C19H24N7O2/c20-12-15-3-1-5-25(14-15)24-9-7-23(8-10-24)18(27)11-17(22)19(28)26-6-2-4-16(26)13-21/h1,3,5,14,16-17H,2,4,6-11,22H2/q+1/t16-,17-/m0/s1
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n/an/a 28n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase 8


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11717
PNG
((2S)-1-(2-{[4-(6-fluoro-1,2,3,4-tetrahydroisoquino...)
Show SMILES CC(C)(CC(=O)N1CCc2cc(F)ccc2C1)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C21H27FN4O2/c1-21(2,24-13-20(28)26-8-3-4-18(26)12-23)11-19(27)25-9-7-15-10-17(22)6-5-16(15)14-25/h5-6,10,18,24H,3-4,7-9,11,13-14H2,1-2H3/t18-/m0/s1
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n/an/a 30n/an/an/an/an/an/a



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...


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))
BDBM50168267
PNG
((S)-1-{(S)-2-Amino-4-[1-(2-hydroxy-ethyl)-6,7-dime...)
Show SMILES COc1cc2CCN(C(CCO)c2cc1OC)C(=O)C[C@H](N)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C22H30N4O5/c1-30-19-10-14-5-8-26(18(6-9-27)16(14)11-20(19)31-2)21(28)12-17(24)22(29)25-7-3-4-15(25)13-23/h10-11,15,17-18,27H,3-9,12,24H2,1-2H3/t15-,17-,18?/m0/s1
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n/an/a 45n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase IV [DPP-IV]


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50168276
PNG
((S)-1-[(S)-2-Amino-4-(1-isopropyl-6,7-dimethoxy-3,...)
Show SMILES COc1cc2CCN(C(C(C)C)c2cc1OC)C(=O)C[C@H](N)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C23H32N4O4/c1-14(2)22-17-11-20(31-4)19(30-3)10-15(17)7-9-27(22)21(28)12-18(25)23(29)26-8-5-6-16(26)13-24/h10-11,14,16,18,22H,5-9,12,25H2,1-4H3/t16-,18-,22?/m0/s1
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n/an/a 47n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase IV [DPP-IV]


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
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



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...


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))
BDBM11695
PNG
((2S)-1-{2-[(3-hydroxyadamantan-1-yl)amino]acetyl}p...)
Show SMILES OC12CC3CC(C1)CC(C3)(C2)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C17H25N3O2/c18-9-14-2-1-3-20(14)15(21)10-19-16-5-12-4-13(6-16)8-17(22,7-12)11-16/h12-14,19,22H,1-8,10-11H2/t12?,13?,14-,16?,17?/m0/s1
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n/an/a 51n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase IV [DPP-IV]


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11695
PNG
((2S)-1-{2-[(3-hydroxyadamantan-1-yl)amino]acetyl}p...)
Show SMILES OC12CC3CC(C1)CC(C3)(C2)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C17H25N3O2/c18-9-14-2-1-3-20(14)15(21)10-19-16-5-12-4-13(6-16)8-17(22,7-12)11-16/h12-14,19,22H,1-8,10-11H2/t12?,13?,14-,16?,17?/m0/s1
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n/an/a 51n/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...


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))
BDBM11113
PNG
(6-{[2-({2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl...)
Show SMILES O=C(CNCCNc1ccc(cn1)C#N)N1CCC[C@H]1C#N
Show InChI InChI=1S/C15H18N6O/c16-8-12-3-4-14(20-10-12)19-6-5-18-11-15(22)21-7-1-2-13(21)9-17/h3-4,10,13,18H,1-2,5-7,11H2,(H,19,20)/t13-/m0/s1
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n/an/a 53n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase IV [DPP-IV]


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11113
PNG
(6-{[2-({2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl...)
Show SMILES O=C(CNCCNc1ccc(cn1)C#N)N1CCC[C@H]1C#N
Show InChI InChI=1S/C15H18N6O/c16-8-12-3-4-14(20-10-12)19-6-5-18-11-15(22)21-7-1-2-13(21)9-17/h3-4,10,13,18H,1-2,5-7,11H2,(H,19,20)/t13-/m0/s1
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n/an/a 53n/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...


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))
BDBM11714
PNG
((2S)-1-(2-{[(2S)-4-oxo-4-(1,2,3,4-tetrahydroisoqui...)
Show SMILES C[C@@H](CC(=O)N1CCc2ccccc2C1)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C20H26N4O2/c1-15(22-13-20(26)24-9-4-7-18(24)12-21)11-19(25)23-10-8-16-5-2-3-6-17(16)14-23/h2-3,5-6,15,18,22H,4,7-11,13-14H2,1H3/t15-,18-/m0/s1
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n/an/a 54n/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))
BDBM50168268
PNG
((S)-1-[(S)-2-Amino-4-(6,7-dimethoxy-3,4-dihydro-1H...)
Show SMILES COc1cc2CCN(Cc2cc1OC)C(=O)C[C@H](N)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C20H26N4O4/c1-27-17-8-13-5-7-23(12-14(13)9-18(17)28-2)19(25)10-16(22)20(26)24-6-3-4-15(24)11-21/h8-9,15-16H,3-7,10,12,22H2,1-2H3/t15-,16-/m0/s1
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n/an/a 63n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase IV [DPP-IV]


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50168272
PNG
((S)-1-[(S)-2-Amino-4-(4-benzoyl-piperazin-1-yl)-4-...)
Show SMILES N[C@@H](CC(=O)N1CCN(CC1)C(=O)c1ccccc1)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C20H25N5O3/c21-14-16-7-4-8-25(16)20(28)17(22)13-18(26)23-9-11-24(12-10-23)19(27)15-5-2-1-3-6-15/h1-3,5-6,16-17H,4,7-13,22H2/t16-,17-/m0/s1
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n/an/a 71n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase 8


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50168265
PNG
((S)-1-[(S)-2-Amino-4-(1-tert-butyl-6-methoxy-3,4-d...)
Show SMILES COc1ccc2C(N(CCc2c1)C(=O)C[C@H](N)C(=O)N1CCC[C@H]1C#N)C(C)(C)C
Show InChI InChI=1S/C23H32N4O3/c1-23(2,3)21-18-8-7-17(30-4)12-15(18)9-11-27(21)20(28)13-19(25)22(29)26-10-5-6-16(26)14-24/h7-8,12,16,19,21H,5-6,9-11,13,25H2,1-4H3/t16-,19-,21?/m0/s1
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n/an/a 72n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase IV [DPP-IV]


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50168274
PNG
((S)-1-[(S)-2-Amino-4-(1-tert-butyl-6,7-dimethoxy-3...)
Show SMILES COc1cc2CCN(C(c2cc1OC)C(C)(C)C)C(=O)C[C@H](N)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C24H34N4O4/c1-24(2,3)22-17-12-20(32-5)19(31-4)11-15(17)8-10-28(22)21(29)13-18(26)23(30)27-9-6-7-16(27)14-25/h11-12,16,18,22H,6-10,13,26H2,1-5H3/t16-,18-,22?/m0/s1
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n/an/a 73n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase IV [DPP-IV]


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11699
PNG
((2S)-1-(2-{[3-(6-fluoro-1,2,3,4-tetrahydroisoquino...)
Show SMILES Fc1ccc2CN(CCc2c1)C(=O)CCNCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C19H23FN4O2/c20-16-4-3-15-13-23(9-6-14(15)10-16)18(25)5-7-22-12-19(26)24-8-1-2-17(24)11-21/h3-4,10,17,22H,1-2,5-9,12-13H2/t17-/m0/s1
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n/an/a 83n/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...


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))
BDBM50168275
PNG
(1-{4-[(S)-3-Amino-4-((S)-2-cyano-pyrrolidin-1-yl)-...)
Show SMILES N[C@@H](CC(=O)N1CCN(CC1)[n+]1cccc(c1)C#N)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C19H24N7O2/c20-12-15-3-1-5-25(14-15)24-9-7-23(8-10-24)18(27)11-17(22)19(28)26-6-2-4-16(26)13-21/h1,3,5,14,16-17H,2,4,6-11,22H2/q+1/t16-,17-/m0/s1
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n/an/a 87n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase IV [DPP-IV]


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50168280
PNG
((S)-1-[(S)-2-Amino-4-(1-benzyl-6,7-dimethoxy-3,4-d...)
Show SMILES COc1cc2CCN(C(Cc3ccccc3)c2cc1OC)C(=O)C[C@H](N)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C27H32N4O4/c1-34-24-14-19-10-12-31(26(32)16-22(29)27(33)30-11-6-9-20(30)17-28)23(21(19)15-25(24)35-2)13-18-7-4-3-5-8-18/h3-5,7-8,14-15,20,22-23H,6,9-13,16,29H2,1-2H3/t20-,22-,23?/m0/s1
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n/an/a 97n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase IV [DPP-IV]


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM12182
PNG
((2S)-1-[(2S)-2-amino-4-oxo-4-(1,2,3,4-tetrahydrois...)
Show SMILES N[C@@H](CC(=O)N1CCc2ccccc2C1)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C18H22N4O2/c19-11-15-6-3-8-22(15)18(24)16(20)10-17(23)21-9-7-13-4-1-2-5-14(13)12-21/h1-2,4-5,15-16H,3,6-10,12,20H2/t15-,16-/m0/s1
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n/an/a 99n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase IV [DPP-IV]


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11697
PNG
((2S)-1-(2-{[3-oxo-3-(1,2,3,4-tetrahydroisoquinolin...)
Show SMILES O=C(CNCCC(=O)N1CCc2ccccc2C1)N1CCC[C@H]1C#N
Show InChI InChI=1S/C19H24N4O2/c20-12-17-6-3-10-23(17)19(25)13-21-9-7-18(24)22-11-8-15-4-1-2-5-16(15)14-22/h1-2,4-5,17,21H,3,6-11,13-14H2/t17-/m0/s1
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n/an/a 116n/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...


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))
BDBM50168279
PNG
((S)-3-Amino-4-((S)-2-cyano-pyrrolidin-1-yl)-N-[2-(...)
Show SMILES COc1ccc(CCNC(=O)C[C@H](N)C(=O)N2CCC[C@H]2C#N)cc1OC
Show InChI InChI=1S/C19H26N4O4/c1-26-16-6-5-13(10-17(16)27-2)7-8-22-18(24)11-15(21)19(25)23-9-3-4-14(23)12-20/h5-6,10,14-15H,3-4,7-9,11,21H2,1-2H3,(H,22,24)/t14-,15-/m0/s1
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n/an/a 116n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase IV [DPP-IV]


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11710
PNG
((2S)-Cyanopyrrolidine analogue 18n | 3-({2-[(2S)-2...)
Show SMILES CC(C)(NC(=O)CCNCC(=O)N1CCC[C@H]1C#N)c1ccccc1
Show InChI InChI=1S/C19H26N4O2/c1-19(2,15-7-4-3-5-8-15)22-17(24)10-11-21-14-18(25)23-12-6-9-16(23)13-20/h3-5,7-8,16,21H,6,9-12,14H2,1-2H3,(H,22,24)/t16-/m0/s1
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n/an/a 119n/an/an/an/an/an/a



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...


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))
BDBM12182
PNG
((2S)-1-[(2S)-2-amino-4-oxo-4-(1,2,3,4-tetrahydrois...)
Show SMILES N[C@@H](CC(=O)N1CCc2ccccc2C1)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C18H22N4O2/c19-11-15-6-3-8-22(15)18(24)16(20)10-17(23)21-9-7-13-4-1-2-5-14(13)12-21/h1-2,4-5,15-16H,3,6-10,12,20H2/t15-,16-/m0/s1
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n/an/a 120n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase 8


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50168272
PNG
((S)-1-[(S)-2-Amino-4-(4-benzoyl-piperazin-1-yl)-4-...)
Show SMILES N[C@@H](CC(=O)N1CCN(CC1)C(=O)c1ccccc1)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C20H25N5O3/c21-14-16-7-4-8-25(16)20(28)17(22)13-18(26)23-9-11-24(12-10-23)19(27)15-5-2-1-3-6-15/h1-3,5-6,16-17H,4,7-13,22H2/t16-,17-/m0/s1
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n/an/a 123n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase IV [DPP-IV]


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
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



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...


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))
BDBM50168273
PNG
((S)-3-Amino-4-((S)-2-cyano-pyrrolidin-1-yl)-4-oxo-...)
Show SMILES CCC(NC(=O)C[C@H](N)C(=O)N1CCC[C@H]1C#N)c1ccccc1
Show InChI InChI=1S/C18H24N4O2/c1-2-16(13-7-4-3-5-8-13)21-17(23)11-15(20)18(24)22-10-6-9-14(22)12-19/h3-5,7-8,14-16H,2,6,9-11,20H2,1H3,(H,21,23)/t14-,15-,16?/m0/s1
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n/an/a 140n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase IV [DPP-IV]


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50168267
PNG
((S)-1-{(S)-2-Amino-4-[1-(2-hydroxy-ethyl)-6,7-dime...)
Show SMILES COc1cc2CCN(C(CCO)c2cc1OC)C(=O)C[C@H](N)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C22H30N4O5/c1-30-19-10-14-5-8-26(18(6-9-27)16(14)11-20(19)31-2)21(28)12-17(24)22(29)25-7-3-4-15(25)13-23/h10-11,15,17-18,27H,3-9,12,24H2,1-2H3/t15-,17-,18?/m0/s1
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n/an/a 174n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase 8


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50168279
PNG
((S)-3-Amino-4-((S)-2-cyano-pyrrolidin-1-yl)-N-[2-(...)
Show SMILES COc1ccc(CCNC(=O)C[C@H](N)C(=O)N2CCC[C@H]2C#N)cc1OC
Show InChI InChI=1S/C19H26N4O4/c1-26-16-6-5-13(10-17(16)27-2)7-8-22-18(24)11-15(21)19(25)23-9-3-4-14(23)12-20/h5-6,10,14-15H,3-4,7-9,11,21H2,1-2H3,(H,22,24)/t14-,15-/m0/s1
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n/an/a 177n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase 8


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50168278
PNG
((S)-3-Amino-4-((S)-2-cyano-pyrrolidin-1-yl)-N-(1-m...)
Show SMILES COCC(Cc1ccccc1)NC(=O)C[C@H](N)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C19H26N4O3/c1-26-13-15(10-14-6-3-2-4-7-14)22-18(24)11-17(21)19(25)23-9-5-8-16(23)12-20/h2-4,6-7,15-17H,5,8-11,13,21H2,1H3,(H,22,24)/t15?,16-,17-/m0/s1
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n/an/a 182n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase IV [DPP-IV]


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50168266
PNG
((S)-1-[(S)-2-Amino-4-(1-tert-butyl-7-methoxy-3,4-d...)
Show SMILES COc1ccc2CCN(C(c2c1)C(C)(C)C)C(=O)C[C@H](N)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C23H32N4O3/c1-23(2,3)21-18-12-17(30-4)8-7-15(18)9-11-27(21)20(28)13-19(25)22(29)26-10-5-6-16(26)14-24/h7-8,12,16,19,21H,5-6,9-11,13,25H2,1-4H3/t16-,19-,21?/m0/s1
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n/an/a 195n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase IV [DPP-IV]


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM11701
PNG
((2S)-1-{2-[(3-{4-[(3,5-difluorophenyl)carbonyl]pip...)
Show SMILES Fc1cc(F)cc(c1)C(=O)N1CCN(CC1)C(=O)CCNCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C21H25F2N5O3/c22-16-10-15(11-17(23)12-16)21(31)27-8-6-26(7-9-27)19(29)3-4-25-14-20(30)28-5-1-2-18(28)13-24/h10-12,18,25H,1-9,14H2/t18-/m0/s1
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n/an/a 202n/an/an/an/an/an/a



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...


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))
BDBM50168271
PNG
((S)-3-Amino-4-((S)-2-cyano-pyrrolidin-1-yl)-N-(2-m...)
Show SMILES CC(C)C(NC(=O)C[C@H](N)C(=O)N1CCC[C@H]1C#N)c1ccccc1
Show InChI InChI=1S/C19H26N4O2/c1-13(2)18(14-7-4-3-5-8-14)22-17(24)11-16(21)19(25)23-10-6-9-15(23)12-20/h3-5,7-8,13,15-16,18H,6,9-11,21H2,1-2H3,(H,22,24)/t15-,16-,18?/m0/s1
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n/an/a 212n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase IV [DPP-IV]


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50168280
PNG
((S)-1-[(S)-2-Amino-4-(1-benzyl-6,7-dimethoxy-3,4-d...)
Show SMILES COc1cc2CCN(C(Cc3ccccc3)c2cc1OC)C(=O)C[C@H](N)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C27H32N4O4/c1-34-24-14-19-10-12-31(26(32)16-22(29)27(33)30-11-6-9-20(30)17-28)23(21(19)15-25(24)35-2)13-18-7-4-3-5-8-18/h3-5,7-8,14-15,20,22-23H,6,9-13,16,29H2,1-2H3/t20-,22-,23?/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
Inhibitory concentration against Dipeptidyl-peptidase 8


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM12183
PNG
((2S)-1-[(2S)-2-amino-4-{4-[bis(4-fluorophenyl)meth...)
Show SMILES N[C@@H](CC(=O)N1CCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C26H29F2N5O2/c27-20-7-3-18(4-8-20)25(19-5-9-21(28)10-6-19)32-14-12-31(13-15-32)24(34)16-23(30)26(35)33-11-1-2-22(33)17-29/h3-10,22-23,25H,1-2,11-16,30H2/t22-,23-/m0/s1
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n/an/a 227n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase IV [DPP-IV]


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50168269
PNG
((S)-3-Amino-N-benzyl-4-((S)-2-cyano-pyrrolidin-1-y...)
Show SMILES N[C@@H](CC(=O)NCc1ccccc1)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C16H20N4O2/c17-10-13-7-4-8-20(13)16(22)14(18)9-15(21)19-11-12-5-2-1-3-6-12/h1-3,5-6,13-14H,4,7-9,11,18H2,(H,19,21)/t13-,14-/m0/s1
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n/an/a 238n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase IV [DPP-IV]


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50168264
PNG
((S)-3-Amino-4-((S)-2-cyano-pyrrolidin-1-yl)-N-(2,2...)
Show SMILES CC(C)(C)C(NC(=O)C[C@H](N)C(=O)N1CCC[C@H]1C#N)c1ccccc1
Show InChI InChI=1S/C20H28N4O2/c1-20(2,3)18(14-8-5-4-6-9-14)23-17(25)12-16(22)19(26)24-11-7-10-15(24)13-21/h4-6,8-9,15-16,18H,7,10-12,22H2,1-3H3,(H,23,25)/t15-,16-,18?/m0/s1
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n/an/a 251n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase IV [DPP-IV]


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50168277
PNG
((S)-3-Amino-4-((S)-2-cyano-pyrrolidin-1-yl)-N-(1,2...)
Show SMILES N[C@@H](CC(=O)NC(Cc1ccccc1)c1ccccc1)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C23H26N4O2/c24-16-19-12-7-13-27(19)23(29)20(25)15-22(28)26-21(18-10-5-2-6-11-18)14-17-8-3-1-4-9-17/h1-6,8-11,19-21H,7,12-15,25H2,(H,26,28)/t19-,20-,21?/m0/s1
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n/an/a 252n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase IV [DPP-IV]


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11712
PNG
((2S)-Cyanopyrrolidine analogue 18p | 3-({2-[(2S)-2...)
Show SMILES O=C(CCNCC(=O)N1CCC[C@H]1C#N)Nc1ccccc1
Show InChI InChI=1S/C16H20N4O2/c17-11-14-7-4-10-20(14)16(22)12-18-9-8-15(21)19-13-5-2-1-3-6-13/h1-3,5-6,14,18H,4,7-10,12H2,(H,19,21)/t14-/m0/s1
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n/an/a 298n/an/an/an/an/an/a



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...


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))
BDBM50168270
PNG
((S)-3-Amino-N-(1-benzyl-2-methyl-propyl)-4-((S)-2-...)
Show SMILES CC(C)C(Cc1ccccc1)NC(=O)C[C@H](N)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C20H28N4O2/c1-14(2)18(11-15-7-4-3-5-8-15)23-19(25)12-17(22)20(26)24-10-6-9-16(24)13-21/h3-5,7-8,14,16-18H,6,9-12,22H2,1-2H3,(H,23,25)/t16-,17-,18?/m0/s1
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n/an/a 305n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase IV [DPP-IV]


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11706
PNG
((2S)-Cyanopyrrolidine analogue 18j | 3-({2-[(2S)-2...)
Show SMILES [O-][N+](=O)c1ccc(CNC(=O)CCNCC(=O)N2CCC[C@H]2C#N)cc1
Show InChI InChI=1S/C17H21N5O4/c18-10-15-2-1-9-21(15)17(24)12-19-8-7-16(23)20-11-13-3-5-14(6-4-13)22(25)26/h3-6,15,19H,1-2,7-9,11-12H2,(H,20,23)/t15-/m0/s1
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n/an/a 317n/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...


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))
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
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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n/an/a 364n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase 8


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11708
PNG
((2S)-Cyanopyrrolidine analogue 18l | 3-({2-[(2S)-2...)
Show SMILES Fc1cc(F)cc(CNC(=O)CCNCC(=O)N2CCC[C@H]2C#N)c1
Show InChI InChI=1S/C17H20F2N4O2/c18-13-6-12(7-14(19)8-13)10-22-16(24)3-4-21-11-17(25)23-5-1-2-15(23)9-20/h6-8,15,21H,1-5,10-11H2,(H,22,24)/t15-/m0/s1
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n/an/a 369n/an/an/an/an/an/a



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...


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))
BDBM50168269
PNG
((S)-3-Amino-N-benzyl-4-((S)-2-cyano-pyrrolidin-1-y...)
Show SMILES N[C@@H](CC(=O)NCc1ccccc1)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C16H20N4O2/c17-10-13-7-4-8-20(13)16(22)14(18)9-15(21)19-11-12-5-2-1-3-6-12/h1-3,5-6,13-14H,4,7-9,11,18H2,(H,19,21)/t13-,14-/m0/s1
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n/an/a 389n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dipeptidyl-peptidase 8


Bioorg Med Chem Lett 15: 3271-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.051
BindingDB Entry DOI: 10.7270/Q2RF5TJX
More data for this
Ligand-Target Pair
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