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14 similar compounds to monomer 50350175

Compile data set for download or QSAR
Wt: 504.5
BDBM12195
Wt: 489.5
BDBM50350165
Wt: 522.5
BDBM50350166
Wt: 521.0
BDBM50350168
Wt: 504.5
BDBM50350169
Purchase
Wt: 518.5
BDBM50350172
Wt: 518.5
BDBM50350174
Wt: 410.4
BDBM50350178
Wt: 516.5
BDBM50350181
Wt: 518.5
BDBM50350182
Wt: 532.5
BDBM50350184
Wt: 504.5
BDBM50350187
Wt: 435.4
BDBM50350189
Wt: 601.6
BDBM50350191

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 46 hits for monomerid = 12195,50350165,50350166,50350168,50350169,50350172,50350174,50350178,50350181,50350182,50350184,50350187,50350189,50350191   
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 VIII


(Homo sapiens (Human))
BDBM12195
PNG
(2-amino-4-{4-[bis(4-fluorophenyl)methyl]piperazin-...)
Show SMILES NC(CC(=O)N1CCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C29H30F2N4O2/c30-24-9-5-20(6-10-24)28(21-7-11-25(31)12-8-21)34-15-13-33(14-16-34)27(36)17-26(32)29(37)35-18-22-3-1-2-4-23(22)19-35/h1-12,26,28H,13-19,32H2
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n/an/a 14n/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 15: 687-91 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.023
BindingDB Entry DOI: 10.7270/Q2XG9PDW
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50350169
PNG
(CHEMBL1814633)
Show SMILES N[C@@H](CC(=O)N1CCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C29H30F2N4O2/c30-24-9-5-20(6-10-24)28(21-7-11-25(31)12-8-21)34-15-13-33(14-16-34)27(36)17-26(32)29(37)35-18-22-3-1-2-4-23(22)19-35/h1-12,26,28H,13-19,32H2/t26-/s2
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n/an/a>1.00E+6n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of DPP2


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM12195
PNG
(2-amino-4-{4-[bis(4-fluorophenyl)methyl]piperazin-...)
Show SMILES NC(CC(=O)N1CCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C29H30F2N4O2/c30-24-9-5-20(6-10-24)28(21-7-11-25(31)12-8-21)34-15-13-33(14-16-34)27(36)17-26(32)29(37)35-18-22-3-1-2-4-23(22)19-35/h1-12,26,28H,13-19,32H2
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n/an/a 3.84E+4n/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...


Bioorg Med Chem Lett 15: 687-91 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.023
BindingDB Entry DOI: 10.7270/Q2XG9PDW
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50350165
PNG
(CHEMBL1814738)
Show SMILES Fc1ccc(cc1)C(N1CCN(CC1)C(=O)CCC(=O)N1Cc2ccccc2C1)c1ccc(F)cc1
Show InChI InChI=1S/C29H29F2N3O2/c30-25-9-5-21(6-10-25)29(22-7-11-26(31)12-8-22)33-17-15-32(16-18-33)27(35)13-14-28(36)34-19-23-3-1-2-4-24(23)20-34/h1-12,29H,13-20H2
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DPP8 assessed as pNA release from Ala-Pro- p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to sub...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50350166
PNG
(CHEMBL1814739)
Show SMILES N[C@@H](CC(=O)N1CCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccc(F)cc2C1
Show InChI InChI=1/C29H29F3N4O2/c30-23-6-1-19(2-7-23)28(20-3-8-24(31)9-4-20)35-13-11-34(12-14-35)27(37)16-26(33)29(38)36-17-21-5-10-25(32)15-22(21)18-36/h1-10,15,26,28H,11-14,16-18,33H2/t26-/s2
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n/an/a 9.40n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DPP8 assessed as pNA release from Ala-Pro- p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to sub...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50350168
PNG
(CHEMBL1814740)
Show SMILES N[C@@H](CC(=O)N1CCN(CC1)C(c1ccccc1)c1ccc(Cl)cc1)C(=O)N1Cc2ccc(F)cc2C1
Show InChI InChI=1/C29H30ClFN4O2/c30-24-9-6-21(7-10-24)28(20-4-2-1-3-5-20)34-14-12-33(13-15-34)27(36)17-26(32)29(37)35-18-22-8-11-25(31)16-23(22)19-35/h1-11,16,26,28H,12-15,17-19,32H2/t26-,28?/s2
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n/an/a 8.80n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DPP8 assessed as pNA release from Ala-Pro- p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to sub...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50350169
PNG
(CHEMBL1814633)
Show SMILES N[C@@H](CC(=O)N1CCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C29H30F2N4O2/c30-24-9-5-20(6-10-24)28(21-7-11-25(31)12-8-21)34-15-13-33(14-16-34)27(36)17-26(32)29(37)35-18-22-3-1-2-4-23(22)19-35/h1-12,26,28H,13-19,32H2/t26-/s2
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n/an/a 12n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DPP8 assessed as pNA release from Ala-Pro- p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to sub...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50350172
PNG
(CHEMBL1814748)
Show SMILES C[C@H]1CN(CCN1C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)C[C@H](N)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C30H32F2N4O2/c1-20-17-34(28(37)16-27(33)30(38)35-18-23-4-2-3-5-24(23)19-35)14-15-36(20)29(21-6-10-25(31)11-7-21)22-8-12-26(32)13-9-22/h2-13,20,27,29H,14-19,33H2,1H3/t20-,27-/s2
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n/an/a 32n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DPP8 assessed as pNA release from Ala-Pro- p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to sub...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50350174
PNG
(CHEMBL1814745)
Show SMILES N[C@@H](CC(=O)N1CCCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C30H32F2N4O2/c31-25-10-6-21(7-11-25)29(22-8-12-26(32)13-9-22)35-15-3-14-34(16-17-35)28(37)18-27(33)30(38)36-19-23-4-1-2-5-24(23)20-36/h1-2,4-13,27,29H,3,14-20,33H2/t27-/s2
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n/an/a 80n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DPP8 assessed as pNA release from Ala-Pro- p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to sub...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50350178
PNG
(CHEMBL1814747)
Show SMILES N[C@@H](CC(=O)N1CCN(Cc2ccc(F)cc2)CC1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C23H27FN4O2/c24-20-7-5-17(6-8-20)14-26-9-11-27(12-10-26)22(29)13-21(25)23(30)28-15-18-3-1-2-4-19(18)16-28/h1-8,21H,9-16,25H2/t21-/s2
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n/an/a 80n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DPP8 assessed as pNA release from Ala-Pro- p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to sub...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50350181
PNG
(CHEMBL1814746)
Show SMILES N[C@@H](CC(=O)N1C[C@H]2C[C@@H]1CN2C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C30H30F2N4O2/c31-23-9-5-19(6-10-23)29(20-7-11-24(32)12-8-20)36-18-25-13-26(36)17-35(25)28(37)14-27(33)30(38)34-15-21-3-1-2-4-22(21)16-34/h1-12,25-27,29H,13-18,33H2/t25-,26-,27+/s2
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n/an/a 230n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DPP8 assessed as pNA release from Ala-Pro- p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to sub...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50350182
PNG
(CHEMBL1814750)
Show SMILES N[C@@H](CC(=O)N1CCN(C(c2ccc(F)cc2)c2ccc(F)cc2)C(=O)C1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C29H28F2N4O3/c30-23-9-5-19(6-10-23)28(20-7-11-24(31)12-8-20)35-14-13-33(18-27(35)37)26(36)15-25(32)29(38)34-16-21-3-1-2-4-22(21)17-34/h1-12,25,28H,13-18,32H2/t25-/s2
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n/an/a 520n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DPP8 assessed as pNA release from Ala-Pro- p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to sub...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50350184
PNG
(CHEMBL1814755)
Show SMILES N[C@@H](CC(=O)N1CCC[C@H]1C(=O)NC(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C30H30F2N4O3/c31-23-11-7-19(8-12-23)28(20-9-13-24(32)14-10-20)34-29(38)26-6-3-15-36(26)27(37)16-25(33)30(39)35-17-21-4-1-2-5-22(21)18-35/h1-2,4-5,7-14,25-26,28H,3,6,15-18,33H2,(H,34,38)/t25-,26-/s2
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n/an/a 910n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DPP8 assessed as pNA release from Ala-Pro- p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to sub...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50350187
PNG
(CHEMBL1814759)
Show SMILES N[C@@H](CC(=O)NC1CCN(C1)C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C29H30F2N4O2/c30-23-9-5-19(6-10-23)28(20-7-11-24(31)12-8-20)34-14-13-25(18-34)33-27(36)15-26(32)29(37)35-16-21-3-1-2-4-22(21)17-35/h1-12,25-26,28H,13-18,32H2,(H,33,36)/t25?,26-/s2
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n/an/a 3.91E+3n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DPP8 assessed as pNA release from Ala-Pro- p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to sub...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50350189
PNG
(CHEMBL1814758)
Show SMILES N[C@@H](CC(=O)NC(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C25H23F2N3O2/c26-20-9-5-16(6-10-20)24(17-7-11-21(27)12-8-17)29-23(31)13-22(28)25(32)30-14-18-3-1-2-4-19(18)15-30/h1-12,22,24H,13-15,28H2,(H,29,31)/t22-/s2
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n/an/a 4.50E+3n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DPP8 assessed as pNA release from Ala-Pro- p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to sub...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50350191
PNG
(CHEMBL1814754)
Show SMILES N[C@@H](CC(=O)N1CCC[C@H]1C(=O)N1CCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C34H37F2N5O3/c35-27-11-7-23(8-12-27)32(24-9-13-28(36)14-10-24)38-16-18-39(19-17-38)34(44)30-6-3-15-41(30)31(42)20-29(37)33(43)40-21-25-4-1-2-5-26(25)22-40/h1-2,4-5,7-14,29-30,32H,3,6,15-22,37H2/t29-,30-/s2
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n/an/a 6.80E+3n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DPP8 assessed as pNA release from Ala-Pro- p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to sub...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50350169
PNG
(CHEMBL1814633)
Show SMILES N[C@@H](CC(=O)N1CCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C29H30F2N4O2/c30-24-9-5-20(6-10-24)28(21-7-11-25(31)12-8-21)34-15-13-33(14-16-34)27(36)17-26(32)29(37)35-18-22-3-1-2-4-23(22)19-35/h1-12,26,28H,13-19,32H2/t26-/s2
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n/an/a>5.00E+4n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP4 assessed as pNA release from Gly-Pro-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50350165
PNG
(CHEMBL1814738)
Show SMILES Fc1ccc(cc1)C(N1CCN(CC1)C(=O)CCC(=O)N1Cc2ccccc2C1)c1ccc(F)cc1
Show InChI InChI=1S/C29H29F2N3O2/c30-25-9-5-21(6-10-25)29(22-7-11-26(31)12-8-22)33-17-15-32(16-18-33)27(35)13-14-28(36)34-19-23-3-1-2-4-24(23)20-34/h1-12,29H,13-20H2
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP4 assessed as pNA release from Gly-Pro-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50350166
PNG
(CHEMBL1814739)
Show SMILES N[C@@H](CC(=O)N1CCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccc(F)cc2C1
Show InChI InChI=1/C29H29F3N4O2/c30-23-6-1-19(2-7-23)28(20-3-8-24(31)9-4-20)35-13-11-34(12-14-35)27(37)16-26(33)29(38)36-17-21-5-10-25(32)15-22(21)18-36/h1-10,15,26,28H,11-14,16-18,33H2/t26-/s2
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n/an/a>5.00E+4n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP4 assessed as pNA release from Gly-Pro-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50350168
PNG
(CHEMBL1814740)
Show SMILES N[C@@H](CC(=O)N1CCN(CC1)C(c1ccccc1)c1ccc(Cl)cc1)C(=O)N1Cc2ccc(F)cc2C1
Show InChI InChI=1/C29H30ClFN4O2/c30-24-9-6-21(7-10-24)28(20-4-2-1-3-5-20)34-14-12-33(13-15-34)27(36)17-26(32)29(37)35-18-22-8-11-25(31)16-23(22)19-35/h1-11,16,26,28H,12-15,17-19,32H2/t26-,28?/s2
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University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP4 assessed as pNA release from Gly-Pro-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50350174
PNG
(CHEMBL1814745)
Show SMILES N[C@@H](CC(=O)N1CCCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C30H32F2N4O2/c31-25-10-6-21(7-11-25)29(22-8-12-26(32)13-9-22)35-15-3-14-34(16-17-35)28(37)18-27(33)30(38)36-19-23-4-1-2-5-24(23)20-36/h1-2,4-13,27,29H,3,14-20,33H2/t27-/s2
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University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP4 assessed as pNA release from Gly-Pro-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50350181
PNG
(CHEMBL1814746)
Show SMILES N[C@@H](CC(=O)N1C[C@H]2C[C@@H]1CN2C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C30H30F2N4O2/c31-23-9-5-19(6-10-23)29(20-7-11-24(32)12-8-20)36-18-25-13-26(36)17-35(25)28(37)14-27(33)30(38)34-15-21-3-1-2-4-22(21)16-34/h1-12,25-27,29H,13-18,33H2/t25-,26-,27+/s2
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University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP4 assessed as pNA release from Gly-Pro-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50350178
PNG
(CHEMBL1814747)
Show SMILES N[C@@H](CC(=O)N1CCN(Cc2ccc(F)cc2)CC1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C23H27FN4O2/c24-20-7-5-17(6-8-20)14-26-9-11-27(12-10-26)22(29)13-21(25)23(30)28-15-18-3-1-2-4-19(18)16-28/h1-8,21H,9-16,25H2/t21-/s2
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University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP4 assessed as pNA release from Gly-Pro-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50350172
PNG
(CHEMBL1814748)
Show SMILES C[C@H]1CN(CCN1C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)C[C@H](N)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C30H32F2N4O2/c1-20-17-34(28(37)16-27(33)30(38)35-18-23-4-2-3-5-24(23)19-35)14-15-36(20)29(21-6-10-25(31)11-7-21)22-8-12-26(32)13-9-22/h2-13,20,27,29H,14-19,33H2,1H3/t20-,27-/s2
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University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP4 assessed as pNA release from Gly-Pro-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50350182
PNG
(CHEMBL1814750)
Show SMILES N[C@@H](CC(=O)N1CCN(C(c2ccc(F)cc2)c2ccc(F)cc2)C(=O)C1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C29H28F2N4O3/c30-23-9-5-19(6-10-23)28(20-7-11-24(31)12-8-20)35-14-13-33(18-27(35)37)26(36)15-25(32)29(38)34-16-21-3-1-2-4-22(21)17-34/h1-12,25,28H,13-18,32H2/t25-/s2
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University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP4 assessed as pNA release from Gly-Pro-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50350191
PNG
(CHEMBL1814754)
Show SMILES N[C@@H](CC(=O)N1CCC[C@H]1C(=O)N1CCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C34H37F2N5O3/c35-27-11-7-23(8-12-27)32(24-9-13-28(36)14-10-24)38-16-18-39(19-17-38)34(44)30-6-3-15-41(30)31(42)20-29(37)33(43)40-21-25-4-1-2-5-26(25)22-40/h1-2,4-5,7-14,29-30,32H,3,6,15-22,37H2/t29-,30-/s2
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University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP4 assessed as pNA release from Gly-Pro-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50350184
PNG
(CHEMBL1814755)
Show SMILES N[C@@H](CC(=O)N1CCC[C@H]1C(=O)NC(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C30H30F2N4O3/c31-23-11-7-19(8-12-23)28(20-9-13-24(32)14-10-20)34-29(38)26-6-3-15-36(26)27(37)16-25(33)30(39)35-17-21-4-1-2-5-22(21)18-35/h1-2,4-5,7-14,25-26,28H,3,6,15-18,33H2,(H,34,38)/t25-,26-/s2
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University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP4 assessed as pNA release from Gly-Pro-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50350189
PNG
(CHEMBL1814758)
Show SMILES N[C@@H](CC(=O)NC(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C25H23F2N3O2/c26-20-9-5-16(6-10-20)24(17-7-11-21(27)12-8-17)29-23(31)13-22(28)25(32)30-14-18-3-1-2-4-19(18)15-30/h1-12,22,24H,13-15,28H2,(H,29,31)/t22-/s2
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University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP4 assessed as pNA release from Gly-Pro-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50350187
PNG
(CHEMBL1814759)
Show SMILES N[C@@H](CC(=O)NC1CCN(C1)C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C29H30F2N4O2/c30-23-9-5-19(6-10-23)28(20-7-11-24(31)12-8-20)34-14-13-25(18-34)33-27(36)15-26(32)29(37)35-16-21-3-1-2-4-22(21)17-35/h1-12,25-26,28H,13-18,32H2,(H,33,36)/t25?,26-/s2
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University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP4 assessed as pNA release from Gly-Pro-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50350187
PNG
(CHEMBL1814759)
Show SMILES N[C@@H](CC(=O)NC1CCN(C1)C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C29H30F2N4O2/c30-23-9-5-19(6-10-23)28(20-7-11-24(31)12-8-20)34-14-13-25(18-34)33-27(36)15-26(32)29(37)35-16-21-3-1-2-4-22(21)17-35/h1-12,25-26,28H,13-18,32H2,(H,33,36)/t25?,26-/s2
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n/an/a 33n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP2 assessed as pNA release from Lys-Ala-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50350189
PNG
(CHEMBL1814758)
Show SMILES N[C@@H](CC(=O)NC(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C25H23F2N3O2/c26-20-9-5-16(6-10-20)24(17-7-11-21(27)12-8-17)29-23(31)13-22(28)25(32)30-14-18-3-1-2-4-19(18)15-30/h1-12,22,24H,13-15,28H2,(H,29,31)/t22-/s2
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n/an/a 650n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP2 assessed as pNA release from Lys-Ala-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50350184
PNG
(CHEMBL1814755)
Show SMILES N[C@@H](CC(=O)N1CCC[C@H]1C(=O)NC(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C30H30F2N4O3/c31-23-11-7-19(8-12-23)28(20-9-13-24(32)14-10-20)34-29(38)26-6-3-15-36(26)27(37)16-25(33)30(39)35-17-21-4-1-2-5-22(21)18-35/h1-2,4-5,7-14,25-26,28H,3,6,15-18,33H2,(H,34,38)/t25-,26-/s2
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n/an/a 2.10E+3n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP2 assessed as pNA release from Lys-Ala-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50350174
PNG
(CHEMBL1814745)
Show SMILES N[C@@H](CC(=O)N1CCCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C30H32F2N4O2/c31-25-10-6-21(7-11-25)29(22-8-12-26(32)13-9-22)35-15-3-14-34(16-17-35)28(37)18-27(33)30(38)36-19-23-4-1-2-5-24(23)20-36/h1-2,4-13,27,29H,3,14-20,33H2/t27-/s2
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n/an/a 3.30E+3n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP2 assessed as pNA release from Lys-Ala-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50350191
PNG
(CHEMBL1814754)
Show SMILES N[C@@H](CC(=O)N1CCC[C@H]1C(=O)N1CCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C34H37F2N5O3/c35-27-11-7-23(8-12-27)32(24-9-13-28(36)14-10-24)38-16-18-39(19-17-38)34(44)30-6-3-15-41(30)31(42)20-29(37)33(43)40-21-25-4-1-2-5-26(25)22-40/h1-2,4-5,7-14,29-30,32H,3,6,15-22,37H2/t29-,30-/s2
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n/an/a 2.30E+4n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP2 assessed as pNA release from Lys-Ala-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50350169
PNG
(CHEMBL1814633)
Show SMILES N[C@@H](CC(=O)N1CCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C29H30F2N4O2/c30-24-9-5-20(6-10-24)28(21-7-11-25(31)12-8-21)34-15-13-33(14-16-34)27(36)17-26(32)29(37)35-18-22-3-1-2-4-23(22)19-35/h1-12,26,28H,13-19,32H2/t26-/s2
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University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP2 assessed as pNA release from Lys-Ala-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50350165
PNG
(CHEMBL1814738)
Show SMILES Fc1ccc(cc1)C(N1CCN(CC1)C(=O)CCC(=O)N1Cc2ccccc2C1)c1ccc(F)cc1
Show InChI InChI=1S/C29H29F2N3O2/c30-25-9-5-21(6-10-25)29(22-7-11-26(31)12-8-22)33-17-15-32(16-18-33)27(35)13-14-28(36)34-19-23-3-1-2-4-24(23)20-34/h1-12,29H,13-20H2
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP2 assessed as pNA release from Lys-Ala-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50350166
PNG
(CHEMBL1814739)
Show SMILES N[C@@H](CC(=O)N1CCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccc(F)cc2C1
Show InChI InChI=1/C29H29F3N4O2/c30-23-6-1-19(2-7-23)28(20-3-8-24(31)9-4-20)35-13-11-34(12-14-35)27(37)16-26(33)29(38)36-17-21-5-10-25(32)15-22(21)18-36/h1-10,15,26,28H,11-14,16-18,33H2/t26-/s2
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University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP2 assessed as pNA release from Lys-Ala-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50350168
PNG
(CHEMBL1814740)
Show SMILES N[C@@H](CC(=O)N1CCN(CC1)C(c1ccccc1)c1ccc(Cl)cc1)C(=O)N1Cc2ccc(F)cc2C1
Show InChI InChI=1/C29H30ClFN4O2/c30-24-9-6-21(7-10-24)28(20-4-2-1-3-5-20)34-14-12-33(13-15-34)27(36)17-26(32)29(37)35-18-22-8-11-25(31)16-23(22)19-35/h1-11,16,26,28H,12-15,17-19,32H2/t26-,28?/s2
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University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP2 assessed as pNA release from Lys-Ala-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50350181
PNG
(CHEMBL1814746)
Show SMILES N[C@@H](CC(=O)N1C[C@H]2C[C@@H]1CN2C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C30H30F2N4O2/c31-23-9-5-19(6-10-23)29(20-7-11-24(32)12-8-20)36-18-25-13-26(36)17-35(25)28(37)14-27(33)30(38)34-15-21-3-1-2-4-22(21)16-34/h1-12,25-27,29H,13-18,33H2/t25-,26-,27+/s2
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University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP2 assessed as pNA release from Lys-Ala-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50350178
PNG
(CHEMBL1814747)
Show SMILES N[C@@H](CC(=O)N1CCN(Cc2ccc(F)cc2)CC1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C23H27FN4O2/c24-20-7-5-17(6-8-20)14-26-9-11-27(12-10-26)22(29)13-21(25)23(30)28-15-18-3-1-2-4-19(18)16-28/h1-8,21H,9-16,25H2/t21-/s2
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University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP2 assessed as pNA release from Lys-Ala-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50350172
PNG
(CHEMBL1814748)
Show SMILES C[C@H]1CN(CCN1C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)C[C@H](N)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C30H32F2N4O2/c1-20-17-34(28(37)16-27(33)30(38)35-18-23-4-2-3-5-24(23)19-35)14-15-36(20)29(21-6-10-25(31)11-7-21)22-8-12-26(32)13-9-22/h2-13,20,27,29H,14-19,33H2,1H3/t20-,27-/s2
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University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP2 assessed as pNA release from Lys-Ala-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50350182
PNG
(CHEMBL1814750)
Show SMILES N[C@@H](CC(=O)N1CCN(C(c2ccc(F)cc2)c2ccc(F)cc2)C(=O)C1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C29H28F2N4O3/c30-23-9-5-19(6-10-23)28(20-7-11-24(31)12-8-20)35-14-13-33(18-27(35)37)26(36)15-25(32)29(38)34-16-21-3-1-2-4-22(21)17-34/h1-12,25,28H,13-18,32H2/t25-/s2
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University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP2 assessed as pNA release from Lys-Ala-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50350169
PNG
(CHEMBL1814633)
Show SMILES N[C@@H](CC(=O)N1CCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C29H30F2N4O2/c30-24-9-5-20(6-10-24)28(21-7-11-25(31)12-8-21)34-15-13-33(14-16-34)27(36)17-26(32)29(37)35-18-22-3-1-2-4-23(22)19-35/h1-12,26,28H,13-19,32H2/t26-/s2
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n/an/a 14n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of DPP8


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50350169
PNG
(CHEMBL1814633)
Show SMILES N[C@@H](CC(=O)N1CCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C29H30F2N4O2/c30-24-9-5-20(6-10-24)28(21-7-11-25(31)12-8-21)34-15-13-33(14-16-34)27(36)17-26(32)29(37)35-18-22-3-1-2-4-23(22)19-35/h1-12,26,28H,13-19,32H2/t26-/s2
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n/an/a 53n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of DPP9


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50350169
PNG
(CHEMBL1814633)
Show SMILES N[C@@H](CC(=O)N1CCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C29H30F2N4O2/c30-24-9-5-20(6-10-24)28(21-7-11-25(31)12-8-21)34-15-13-33(14-16-34)27(36)17-26(32)29(37)35-18-22-3-1-2-4-23(22)19-35/h1-12,26,28H,13-19,32H2/t26-/s2
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University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of DPP4


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM12195
PNG
(2-amino-4-{4-[bis(4-fluorophenyl)methyl]piperazin-...)
Show SMILES NC(CC(=O)N1CCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)N1Cc2ccccc2C1
Show InChI InChI=1/C29H30F2N4O2/c30-24-9-5-20(6-10-24)28(21-7-11-25(31)12-8-21)34-15-13-33(14-16-34)27(36)17-26(32)29(37)35-18-22-3-1-2-4-23(22)19-35/h1-12,26,28H,13-19,32H2
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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 15: 687-91 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.023
BindingDB Entry DOI: 10.7270/Q2XG9PDW
More data for this
Ligand-Target Pair