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PubMed code 17434732

Compile data set for download or QSAR
Found 99 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11162
PNG
((1R)-3-oxo-3-[3-(trifluoroethyl)-5,6-dihydro[1,2,4...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cc(F)c(F)cc1F |r|
Show InChI InChI=1S/C16H15F6N5O/c17-10-6-12(19)11(18)4-8(10)3-9(23)5-14(28)26-1-2-27-13(7-26)24-25-15(27)16(20,21)22/h4,6,9H,1-3,5,7,23H2/t9-/m1/s1
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n/an/a 18n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM15561
PNG
((3R)-3-amino-4-(5-chloro-2-fluorophenyl)-1-[3-(tri...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cc(Cl)ccc1F |r|
Show InChI InChI=1S/C16H16ClF4N5O/c17-10-1-2-12(18)9(5-10)6-11(22)7-14(27)25-3-4-26-13(8-25)23-24-15(26)16(19,20)21/h1-2,5,11H,3-4,6-8,22H2/t11-/m1/s1
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n/an/a 21n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210657
PNG
((R)-3-amino-4-(2,4-dichlorophenyl)-1-(3-(trifluoro...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccc(Cl)cc1Cl
Show InChI InChI=1S/C16H16Cl2F3N5O/c17-10-2-1-9(12(18)6-10)5-11(22)7-14(27)25-3-4-26-13(8-25)23-24-15(26)16(19,20)21/h1-2,6,11H,3-5,7-8,22H2/t11-/m1/s1
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n/an/a 23n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11160
PNG
((3R)-3-amino-4-(2,5-difluorophenyl)-1-[3-(trifluor...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cc(F)ccc1F |r|
Show InChI InChI=1S/C16H16F5N5O/c17-10-1-2-12(18)9(5-10)6-11(22)7-14(27)25-3-4-26-13(8-25)23-24-15(26)16(19,20)21/h1-2,5,11H,3-4,6-8,22H2/t11-/m1/s1
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n/an/a 27n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210649
PNG
((R)-3-amino-1-(3-(difluoromethyl)-5,6-dihydro-[1,2...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)F)Cc1cc(F)c(F)cc1F
Show InChI InChI=1S/C16H16F5N5O/c17-10-6-12(19)11(18)4-8(10)3-9(22)5-14(27)25-1-2-26-13(7-25)23-24-16(26)15(20)21/h4,6,9,15H,1-3,5,7,22H2/t9-/m1/s1
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n/an/a 29n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210668
PNG
((3R)-3-amino-4-(2,5-difluorophenyl)-1-(3-(2,4-difl...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2-c1ccc(F)cc1F)Cc1cc(F)ccc1F
Show InChI InChI=1S/C21H19F4N5O/c22-13-2-4-17(24)12(7-13)8-15(26)10-20(31)29-5-6-30-19(11-29)27-28-21(30)16-3-1-14(23)9-18(16)25/h1-4,7,9,15H,5-6,8,10-11,26H2/t15-/m1/s1
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n/an/a 30n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210647
PNG
((R)-3-amino-1-(3-cyclopropyl-5,6-dihydro-[1,2,4]tr...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C1CC1)Cc1cc(F)c(F)cc1F
Show InChI InChI=1S/C18H20F3N5O/c19-13-8-15(21)14(20)6-11(13)5-12(22)7-17(27)25-3-4-26-16(9-25)23-24-18(26)10-1-2-10/h6,8,10,12H,1-5,7,9,22H2/t12-/m1/s1
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n/an/a 30n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210652
PNG
((R)-3-amino-1-(3-ethyl-5,6-dihydro-[1,2,4]triazolo...)
Show SMILES CCc1nnc2CN(CCn12)C(=O)C[C@H](N)Cc1cc(F)c(F)cc1F |r|
Show InChI InChI=1S/C17H20F3N5O/c1-2-15-22-23-16-9-24(3-4-25(15)16)17(26)7-11(21)5-10-6-13(19)14(20)8-12(10)18/h6,8,11H,2-5,7,9,21H2,1H3/t11-/m1/s1
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n/an/a 37n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210650
PNG
((R)-3-amino-4-(3-chlorophenyl)-1-(3-(trifluorometh...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cccc(Cl)c1
Show InChI InChI=1S/C16H17ClF3N5O/c17-11-3-1-2-10(6-11)7-12(21)8-14(26)24-4-5-25-13(9-24)22-23-15(25)16(18,19)20/h1-3,6,12H,4-5,7-9,21H2/t12-/m1/s1
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n/an/a 59n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210672
PNG
((R)-3-amino-4-(2,5-difluorophenyl)-1-(3-(4-fluorop...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2-c1ccc(F)cc1)Cc1cc(F)ccc1F
Show InChI InChI=1S/C21H20F3N5O/c22-15-3-1-13(2-4-15)21-27-26-19-12-28(7-8-29(19)21)20(30)11-17(25)10-14-9-16(23)5-6-18(14)24/h1-6,9,17H,7-8,10-12,25H2/t17-/m1/s1
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n/an/a 60n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210648
PNG
((R)-3-amino-4-(2,5-difluorophenyl)-1-(3-(pyridin-4...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2-c1ccncc1)Cc1cc(F)ccc1F
Show InChI InChI=1S/C20H20F2N6O/c21-15-1-2-17(22)14(9-15)10-16(23)11-19(29)27-7-8-28-18(12-27)25-26-20(28)13-3-5-24-6-4-13/h1-6,9,16H,7-8,10-12,23H2/t16-/m1/s1
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n/an/a 65n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210670
PNG
((R)-3-amino-4-(2,5-difluorophenyl)-1-(3-(hydroxyme...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(CO)nnc2C1)Cc1cc(F)ccc1F
Show InChI InChI=1S/C16H19F2N5O2/c17-11-1-2-13(18)10(5-11)6-12(19)7-16(25)22-3-4-23-14(8-22)20-21-15(23)9-24/h1-2,5,12,24H,3-4,6-9,19H2/t12-/m1/s1
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n/an/a 69n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210669
PNG
((R)-3-amino-4-(4-chloro-2,5-difluorophenyl)-1-(3-(...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cc(F)c(Cl)cc1F
Show InChI InChI=1S/C16H15ClF5N5O/c17-10-6-11(18)8(4-12(10)19)3-9(23)5-14(28)26-1-2-27-13(7-26)24-25-15(27)16(20,21)22/h4,6,9H,1-3,5,7,23H2/t9-/m1/s1
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n/an/a 76n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210665
PNG
((R)-3-amino-4-(2,4-difluorophenyl)-1-(3-(trifluoro...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccc(F)cc1F
Show InChI InChI=1S/C16H16F5N5O/c17-10-2-1-9(12(18)6-10)5-11(22)7-14(27)25-3-4-26-13(8-25)23-24-15(26)16(19,20)21/h1-2,6,11H,3-5,7-8,22H2/t11-/m1/s1
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n/an/a 82n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210643
PNG
((R)-3-amino-4-(2-chloro-4,5-difluorophenyl)-1-(3-(...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cc(F)c(F)cc1Cl
Show InChI InChI=1S/C16H15ClF5N5O/c17-10-6-12(19)11(18)4-8(10)3-9(23)5-14(28)26-1-2-27-13(7-26)24-25-15(27)16(20,21)22/h4,6,9H,1-3,5,7,23H2/t9-/m1/s1
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n/an/a 84n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210658
PNG
((R)-3-amino-1-(3-(trifluoromethyl)-5,6-dihydro-[1,...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1c(F)cc(F)cc1F |r|
Show InChI InChI=1S/C16H15F6N5O/c17-8-3-11(18)10(12(19)4-8)5-9(23)6-14(28)26-1-2-27-13(7-26)24-25-15(27)16(20,21)22/h3-4,9H,1-2,5-7,23H2/t9-/m1/s1
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n/an/a 87n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210663
PNG
((R)-3-amino-4-(2-fluorophenyl)-1-(3-(trifluorometh...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccccc1F |r|
Show InChI InChI=1S/C16H17F4N5O/c17-12-4-2-1-3-10(12)7-11(21)8-14(26)24-5-6-25-13(9-24)22-23-15(25)16(18,19)20/h1-4,11H,5-9,21H2/t11-/m1/s1
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n/an/a 98n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM11159
PNG
((1R)-1-(3,4-difluorobenzyl)-3-oxo-3-[3-(trifluorom...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccc(F)c(F)c1 |r|
Show InChI InChI=1S/C16H16F5N5O/c17-11-2-1-9(6-12(11)18)5-10(22)7-14(27)25-3-4-26-13(8-25)23-24-15(26)16(19,20)21/h1-2,6,10H,3-5,7-8,22H2/t10-/m1/s1
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n/an/a 128n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210662
PNG
((R)-3-amino-4-(3-fluorophenyl)-1-(3-(trifluorometh...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cccc(F)c1
Show InChI InChI=1S/C16H17F4N5O/c17-11-3-1-2-10(6-11)7-12(21)8-14(26)24-4-5-25-13(9-24)22-23-15(25)16(18,19)20/h1-3,6,12H,4-5,7-9,21H2/t12-/m1/s1
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n/an/a 135n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210661
PNG
((R)-3-amino-4-(2-chlorophenyl)-1-(3-(trifluorometh...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccccc1Cl
Show InChI InChI=1S/C16H17ClF3N5O/c17-12-4-2-1-3-10(12)7-11(21)8-14(26)24-5-6-25-13(9-24)22-23-15(25)16(18,19)20/h1-4,11H,5-9,21H2/t11-/m1/s1
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n/an/a 145n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210653
PNG
((R)-3-amino-1-(3-(trifluoromethyl)-5,6-dihydro-[1,...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1c(F)ccc(F)c1F |r|
Show InChI InChI=1S/C16H15F6N5O/c17-10-1-2-11(18)14(19)9(10)5-8(23)6-13(28)26-3-4-27-12(7-26)24-25-15(27)16(20,21)22/h1-2,8H,3-7,23H2/t8-/m1/s1
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n/an/a 151n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210664
PNG
((R)-3-amino-4-(2,5-dichlorophenyl)-1-(3-(trifluoro...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cc(Cl)ccc1Cl
Show InChI InChI=1S/C16H16Cl2F3N5O/c17-10-1-2-12(18)9(5-10)6-11(22)7-14(27)25-3-4-26-13(8-25)23-24-15(26)16(19,20)21/h1-2,5,11H,3-4,6-8,22H2/t11-/m1/s1
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n/an/a 180n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210651
PNG
((R)-ethyl 7-(3-amino-4-(2,5-difluorophenyl)butanoy...)
Show SMILES CCOC(=O)c1nnc2CN(CCn12)C(=O)C[C@H](N)Cc1cc(F)ccc1F
Show InChI InChI=1S/C18H21F2N5O3/c1-2-28-18(27)17-23-22-15-10-24(5-6-25(15)17)16(26)9-13(21)8-11-7-12(19)3-4-14(11)20/h3-4,7,13H,2,5-6,8-10,21H2,1H3/t13-/m1/s1
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n/an/a 190n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210666
PNG
((R)-ethyl 7-(3-amino-4-(2,4,5-trifluorophenyl)buta...)
Show SMILES CCOC(=O)c1nnc2CN(CCn12)C(=O)C[C@H](N)Cc1cc(F)c(F)cc1F
Show InChI InChI=1S/C18H20F3N5O3/c1-2-29-18(28)17-24-23-15-9-25(3-4-26(15)17)16(27)7-11(22)5-10-6-13(20)14(21)8-12(10)19/h6,8,11H,2-5,7,9,22H2,1H3/t11-/m1/s1
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n/an/a 219n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210671
PNG
((R)-7-(3-amino-4-(2,4,5-trifluorophenyl)butanoyl)-...)
Show SMILES CC(C)(C)NC(=O)c1nnc2CN(CCn12)C(=O)C[C@H](N)Cc1cc(F)c(F)cc1F
Show InChI InChI=1S/C20H25F3N6O2/c1-20(2,3)25-19(31)18-27-26-16-10-28(4-5-29(16)18)17(30)8-12(24)6-11-7-14(22)15(23)9-13(11)21/h7,9,12H,4-6,8,10,24H2,1-3H3,(H,25,31)/t12-/m1/s1
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n/an/a 234n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210660
PNG
((R)-3-amino-4-(4-chlorophenyl)-1-(3-(trifluorometh...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C16H17ClF3N5O/c17-11-3-1-10(2-4-11)7-12(21)8-14(26)24-5-6-25-13(9-24)22-23-15(25)16(18,19)20/h1-4,12H,5-9,21H2/t12-/m1/s1
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n/an/a 264n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210645
PNG
((R)-3-amino-4-(4-fluorophenyl)-1-(3-(trifluorometh...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccc(F)cc1
Show InChI InChI=1S/C16H17F4N5O/c17-11-3-1-10(2-4-11)7-12(21)8-14(26)24-5-6-25-13(9-24)22-23-15(25)16(18,19)20/h1-4,12H,5-9,21H2/t12-/m1/s1
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n/an/a 272n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210659
PNG
((R)-3-amino-1-(3-(trifluoromethyl)-5,6-dihydro-[1,...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C17H17F6N5O/c18-16(19,20)11-3-1-2-10(6-11)7-12(24)8-14(29)27-4-5-28-13(9-27)25-26-15(28)17(21,22)23/h1-3,6,12H,4-5,7-9,24H2/t12-/m1/s1
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n/an/a 366n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210644
PNG
((R)-3-amino-1-(3-(trifluoromethyl)-5,6-dihydro-[1,...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccccc1C(F)(F)F
Show InChI InChI=1S/C17H17F6N5O/c18-16(19,20)12-4-2-1-3-10(12)7-11(24)8-14(29)27-5-6-28-13(9-27)25-26-15(28)17(21,22)23/h1-4,11H,5-9,24H2/t11-/m1/s1
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n/an/a 486n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210667
PNG
((R)-3-amino-1-(3-(trifluoromethyl)-5,6-dihydro-[1,...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C17H17F6N5O/c18-16(19,20)11-3-1-10(2-4-11)7-12(24)8-14(29)27-5-6-28-13(9-27)25-26-15(28)17(21,22)23/h1-4,12H,5-9,24H2/t12-/m1/s1
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n/an/a 511n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210655
PNG
((R)-3-amino-1-(3-(trifluoromethyl)-5,6-dihydro-[1,...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cc(F)cc(F)c1F |r|
Show InChI InChI=1S/C16H15F6N5O/c17-9-3-8(14(19)11(18)5-9)4-10(23)6-13(28)26-1-2-27-12(7-26)24-25-15(27)16(20,21)22/h3,5,10H,1-2,4,6-7,23H2/t10-/m1/s1
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n/an/a 805n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210672
PNG
((R)-3-amino-4-(2,5-difluorophenyl)-1-(3-(4-fluorop...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2-c1ccc(F)cc1)Cc1cc(F)ccc1F
Show InChI InChI=1S/C21H20F3N5O/c22-15-3-1-13(2-4-15)21-27-26-19-12-28(7-8-29(19)21)20(30)11-17(25)10-14-9-16(23)5-6-18(14)24/h1-6,9,17H,7-8,10-12,25H2/t17-/m1/s1
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n/an/a 979n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210668
PNG
((3R)-3-amino-4-(2,5-difluorophenyl)-1-(3-(2,4-difl...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2-c1ccc(F)cc1F)Cc1cc(F)ccc1F
Show InChI InChI=1S/C21H19F4N5O/c22-13-2-4-17(24)12(7-13)8-15(26)10-20(31)29-5-6-30-19(11-29)27-28-21(30)16-3-1-14(23)9-18(16)25/h1-4,7,9,15H,5-6,8,10-11,26H2/t15-/m1/s1
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n/an/a 1.01E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210654
PNG
((R)-3-amino-4-(perfluorophenyl)-1-(3-(trifluoromet...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1c(F)c(F)c(F)c(F)c1F
Show InChI InChI=1S/C16H13F8N5O/c17-10-7(11(18)13(20)14(21)12(10)19)3-6(25)4-9(30)28-1-2-29-8(5-28)26-27-15(29)16(22,23)24/h6H,1-5,25H2/t6-/m1/s1
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n/an/a 1.02E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50210656
PNG
((R)-3-amino-4-(3,4-dichlorophenyl)-1-(3-(trifluoro...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C16H16Cl2F3N5O/c17-11-2-1-9(6-12(11)18)5-10(22)7-14(27)25-3-4-26-13(8-25)23-24-15(26)16(19,20)21/h1-2,6,10H,3-5,7-8,22H2/t10-/m1/s1
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n/an/a 1.58E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210648
PNG
((R)-3-amino-4-(2,5-difluorophenyl)-1-(3-(pyridin-4...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2-c1ccncc1)Cc1cc(F)ccc1F
Show InChI InChI=1S/C20H20F2N6O/c21-15-1-2-17(22)14(9-15)10-16(23)11-19(29)27-7-8-28-18(12-27)25-26-20(28)13-3-5-24-6-4-13/h1-6,9,16H,7-8,10-12,23H2/t16-/m1/s1
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n/an/a 4.20E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210653
PNG
((R)-3-amino-1-(3-(trifluoromethyl)-5,6-dihydro-[1,...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1c(F)ccc(F)c1F |r|
Show InChI InChI=1S/C16H15F6N5O/c17-10-1-2-11(18)14(19)9(10)5-8(23)6-13(28)26-3-4-27-12(7-26)24-25-15(27)16(20,21)22/h1-2,8H,3-7,23H2/t8-/m1/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210658
PNG
((R)-3-amino-1-(3-(trifluoromethyl)-5,6-dihydro-[1,...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1c(F)cc(F)cc1F |r|
Show InChI InChI=1S/C16H15F6N5O/c17-8-3-11(18)10(12(19)4-8)5-9(23)6-14(28)26-1-2-27-13(7-26)24-25-15(27)16(20,21)22/h3-4,9H,1-2,5-7,23H2/t9-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210655
PNG
((R)-3-amino-1-(3-(trifluoromethyl)-5,6-dihydro-[1,...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cc(F)cc(F)c1F |r|
Show InChI InChI=1S/C16H15F6N5O/c17-9-3-8(14(19)11(18)5-9)4-10(23)6-13(28)26-1-2-27-12(7-26)24-25-15(27)16(20,21)22/h3,5,10H,1-2,4,6-7,23H2/t10-/m1/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210666
PNG
((R)-ethyl 7-(3-amino-4-(2,4,5-trifluorophenyl)buta...)
Show SMILES CCOC(=O)c1nnc2CN(CCn12)C(=O)C[C@H](N)Cc1cc(F)c(F)cc1F
Show InChI InChI=1S/C18H20F3N5O3/c1-2-29-18(28)17-24-23-15-9-25(3-4-26(15)17)16(27)7-11(22)5-10-6-13(20)14(21)8-12(10)19/h6,8,11H,2-5,7,9,22H2,1H3/t11-/m1/s1
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n/an/a>2.20E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210660
PNG
((R)-3-amino-4-(4-chlorophenyl)-1-(3-(trifluorometh...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C16H17ClF3N5O/c17-11-3-1-10(2-4-11)7-12(21)8-14(26)24-5-6-25-13(9-24)22-23-15(25)16(18,19)20/h1-4,12H,5-9,21H2/t12-/m1/s1
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n/an/a 2.60E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210657
PNG
((R)-3-amino-4-(2,4-dichlorophenyl)-1-(3-(trifluoro...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccc(Cl)cc1Cl
Show InChI InChI=1S/C16H16Cl2F3N5O/c17-10-2-1-9(12(18)6-10)5-11(22)7-14(27)25-3-4-26-13(8-25)23-24-15(26)16(19,20)21/h1-2,6,11H,3-5,7-8,22H2/t11-/m1/s1
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n/an/a 3.00E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210651
PNG
((R)-ethyl 7-(3-amino-4-(2,5-difluorophenyl)butanoy...)
Show SMILES CCOC(=O)c1nnc2CN(CCn12)C(=O)C[C@H](N)Cc1cc(F)ccc1F
Show InChI InChI=1S/C18H21F2N5O3/c1-2-28-18(27)17-23-22-15-10-24(5-6-25(15)17)16(26)9-13(21)8-11-7-12(19)3-4-14(11)20/h3-4,7,13H,2,5-6,8-10,21H2,1H3/t13-/m1/s1
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n/an/a 3.70E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210652
PNG
((R)-3-amino-1-(3-ethyl-5,6-dihydro-[1,2,4]triazolo...)
Show SMILES CCc1nnc2CN(CCn12)C(=O)C[C@H](N)Cc1cc(F)c(F)cc1F |r|
Show InChI InChI=1S/C17H20F3N5O/c1-2-15-22-23-16-9-24(3-4-25(15)16)17(26)7-11(21)5-10-6-13(19)14(20)8-12(10)18/h6,8,11H,2-5,7,9,21H2,1H3/t11-/m1/s1
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n/an/a 3.90E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM11159
PNG
((1R)-1-(3,4-difluorobenzyl)-3-oxo-3-[3-(trifluorom...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccc(F)c(F)c1 |r|
Show InChI InChI=1S/C16H16F5N5O/c17-11-2-1-9(6-12(11)18)5-10(22)7-14(27)25-3-4-26-13(8-25)23-24-15(26)16(19,20)21/h1-2,6,10H,3-5,7-8,22H2/t10-/m1/s1
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n/an/a 4.60E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM11162
PNG
((1R)-3-oxo-3-[3-(trifluoroethyl)-5,6-dihydro[1,2,4...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cc(F)c(F)cc1F |r|
Show InChI InChI=1S/C16H15F6N5O/c17-10-6-12(19)11(18)4-8(10)3-9(23)5-14(28)26-1-2-27-13(7-26)24-25-15(27)16(20,21)22/h4,6,9H,1-3,5,7,23H2/t9-/m1/s1
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n/an/a 4.80E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210669
PNG
((R)-3-amino-4-(4-chloro-2,5-difluorophenyl)-1-(3-(...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cc(F)c(Cl)cc1F
Show InChI InChI=1S/C16H15ClF5N5O/c17-10-6-11(18)8(4-12(10)19)3-9(23)5-14(28)26-1-2-27-13(7-26)24-25-15(27)16(20,21)22/h4,6,9H,1-3,5,7,23H2/t9-/m1/s1
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n/an/a 4.90E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210657
PNG
((R)-3-amino-4-(2,4-dichlorophenyl)-1-(3-(trifluoro...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccc(Cl)cc1Cl
Show InChI InChI=1S/C16H16Cl2F3N5O/c17-10-2-1-9(12(18)6-10)5-11(22)7-14(27)25-3-4-26-13(8-25)23-24-15(26)16(19,20)21/h1-2,6,11H,3-5,7-8,22H2/t11-/m1/s1
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n/an/a 4.90E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210647
PNG
((R)-3-amino-1-(3-cyclopropyl-5,6-dihydro-[1,2,4]tr...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C1CC1)Cc1cc(F)c(F)cc1F
Show InChI InChI=1S/C18H20F3N5O/c19-13-8-15(21)14(20)6-11(13)5-12(22)7-17(27)25-3-4-26-16(9-25)23-24-18(26)10-1-2-10/h6,8,10,12H,1-5,7,9,22H2/t12-/m1/s1
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n/an/a 5.40E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210668
PNG
((3R)-3-amino-4-(2,5-difluorophenyl)-1-(3-(2,4-difl...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2-c1ccc(F)cc1F)Cc1cc(F)ccc1F
Show InChI InChI=1S/C21H19F4N5O/c22-13-2-4-17(24)12(7-13)8-15(26)10-20(31)29-5-6-30-19(11-29)27-28-21(30)16-3-1-14(23)9-18(16)25/h1-4,7,9,15H,5-6,8,10-11,26H2/t15-/m1/s1
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n/an/a>5.80E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210671
PNG
((R)-7-(3-amino-4-(2,4,5-trifluorophenyl)butanoyl)-...)
Show SMILES CC(C)(C)NC(=O)c1nnc2CN(CCn12)C(=O)C[C@H](N)Cc1cc(F)c(F)cc1F
Show InChI InChI=1S/C20H25F3N6O2/c1-20(2,3)25-19(31)18-27-26-16-10-28(4-5-29(16)18)17(30)8-12(24)6-11-7-14(22)15(23)9-13(11)21/h7,9,12H,4-6,8,10,24H2,1-3H3,(H,25,31)/t12-/m1/s1
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n/an/a 6.30E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210645
PNG
((R)-3-amino-4-(4-fluorophenyl)-1-(3-(trifluorometh...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccc(F)cc1
Show InChI InChI=1S/C16H17F4N5O/c17-11-3-1-10(2-4-11)7-12(21)8-14(26)24-5-6-25-13(9-24)22-23-15(25)16(18,19)20/h1-4,12H,5-9,21H2/t12-/m1/s1
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n/an/a 6.50E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM11160
PNG
((3R)-3-amino-4-(2,5-difluorophenyl)-1-[3-(trifluor...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cc(F)ccc1F |r|
Show InChI InChI=1S/C16H16F5N5O/c17-10-1-2-12(18)9(5-10)6-11(22)7-14(27)25-3-4-26-13(8-25)23-24-15(26)16(19,20)21/h1-2,5,11H,3-4,6-8,22H2/t11-/m1/s1
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n/an/a 6.90E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210660
PNG
((R)-3-amino-4-(4-chlorophenyl)-1-(3-(trifluorometh...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C16H17ClF3N5O/c17-11-3-1-10(2-4-11)7-12(21)8-14(26)24-5-6-25-13(9-24)22-23-15(25)16(18,19)20/h1-4,12H,5-9,21H2/t12-/m1/s1
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n/an/a 7.20E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210663
PNG
((R)-3-amino-4-(2-fluorophenyl)-1-(3-(trifluorometh...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccccc1F |r|
Show InChI InChI=1S/C16H17F4N5O/c17-12-4-2-1-3-10(12)7-11(21)8-14(26)24-5-6-25-13(9-24)22-23-15(25)16(18,19)20/h1-4,11H,5-9,21H2/t11-/m1/s1
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n/an/a 7.50E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210651
PNG
((R)-ethyl 7-(3-amino-4-(2,5-difluorophenyl)butanoy...)
Show SMILES CCOC(=O)c1nnc2CN(CCn12)C(=O)C[C@H](N)Cc1cc(F)ccc1F
Show InChI InChI=1S/C18H21F2N5O3/c1-2-28-18(27)17-23-22-15-10-24(5-6-25(15)17)16(26)9-13(21)8-11-7-12(19)3-4-14(11)20/h3-4,7,13H,2,5-6,8-10,21H2,1H3/t13-/m1/s1
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n/an/a>7.80E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210666
PNG
((R)-ethyl 7-(3-amino-4-(2,4,5-trifluorophenyl)buta...)
Show SMILES CCOC(=O)c1nnc2CN(CCn12)C(=O)C[C@H](N)Cc1cc(F)c(F)cc1F
Show InChI InChI=1S/C18H20F3N5O3/c1-2-29-18(28)17-24-23-15-9-25(3-4-26(15)17)16(27)7-11(22)5-10-6-13(20)14(21)8-12(10)19/h6,8,11H,2-5,7,9,22H2,1H3/t11-/m1/s1
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n/an/a 7.80E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210665
PNG
((R)-3-amino-4-(2,4-difluorophenyl)-1-(3-(trifluoro...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccc(F)cc1F
Show InChI InChI=1S/C16H16F5N5O/c17-10-2-1-9(12(18)6-10)5-11(22)7-14(27)25-3-4-26-13(8-25)23-24-15(26)16(19,20)21/h1-2,6,11H,3-5,7-8,22H2/t11-/m1/s1
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n/an/a 8.30E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210649
PNG
((R)-3-amino-1-(3-(difluoromethyl)-5,6-dihydro-[1,2...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)F)Cc1cc(F)c(F)cc1F
Show InChI InChI=1S/C16H16F5N5O/c17-10-6-12(19)11(18)4-8(10)3-9(22)5-14(27)25-1-2-26-13(7-25)23-24-16(26)15(20)21/h4,6,9,15H,1-3,5,7,22H2/t9-/m1/s1
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n/an/a 8.60E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM15561
PNG
((3R)-3-amino-4-(5-chloro-2-fluorophenyl)-1-[3-(tri...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cc(Cl)ccc1F |r|
Show InChI InChI=1S/C16H16ClF4N5O/c17-10-1-2-12(18)9(5-10)6-11(22)7-14(27)25-3-4-26-13(8-25)23-24-15(26)16(19,20)21/h1-2,5,11H,3-4,6-8,22H2/t11-/m1/s1
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n/an/a 9.80E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210643
PNG
((R)-3-amino-4-(2-chloro-4,5-difluorophenyl)-1-(3-(...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cc(F)c(F)cc1Cl
Show InChI InChI=1S/C16H15ClF5N5O/c17-10-6-12(19)11(18)4-8(10)3-9(23)5-14(28)26-1-2-27-13(7-26)24-25-15(27)16(20,21)22/h4,6,9H,1-3,5,7,23H2/t9-/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210654
PNG
((R)-3-amino-4-(perfluorophenyl)-1-(3-(trifluoromet...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1c(F)c(F)c(F)c(F)c1F
Show InChI InChI=1S/C16H13F8N5O/c17-10-7(11(18)13(20)14(21)12(10)19)3-6(25)4-9(30)28-1-2-29-8(5-28)26-27-15(29)16(22,23)24/h6H,1-5,25H2/t6-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210672
PNG
((R)-3-amino-4-(2,5-difluorophenyl)-1-(3-(4-fluorop...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2-c1ccc(F)cc1)Cc1cc(F)ccc1F
Show InChI InChI=1S/C21H20F3N5O/c22-15-3-1-13(2-4-15)21-27-26-19-12-28(7-8-29(19)21)20(30)11-17(25)10-14-9-16(23)5-6-18(14)24/h1-6,9,17H,7-8,10-12,25H2/t17-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210661
PNG
((R)-3-amino-4-(2-chlorophenyl)-1-(3-(trifluorometh...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccccc1Cl
Show InChI InChI=1S/C16H17ClF3N5O/c17-12-4-2-1-3-10(12)7-11(21)8-14(26)24-5-6-25-13(9-24)22-23-15(25)16(18,19)20/h1-4,11H,5-9,21H2/t11-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210650
PNG
((R)-3-amino-4-(3-chlorophenyl)-1-(3-(trifluorometh...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cccc(Cl)c1
Show InChI InChI=1S/C16H17ClF3N5O/c17-11-3-1-2-10(6-11)7-12(21)8-14(26)24-4-5-25-13(9-24)22-23-15(25)16(18,19)20/h1-3,6,12H,4-5,7-9,21H2/t12-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210667
PNG
((R)-3-amino-1-(3-(trifluoromethyl)-5,6-dihydro-[1,...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C17H17F6N5O/c18-16(19,20)11-3-1-10(2-4-11)7-12(24)8-14(29)27-5-6-28-13(9-27)25-26-15(28)17(21,22)23/h1-4,12H,5-9,24H2/t12-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210648
PNG
((R)-3-amino-4-(2,5-difluorophenyl)-1-(3-(pyridin-4...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2-c1ccncc1)Cc1cc(F)ccc1F
Show InChI InChI=1S/C20H20F2N6O/c21-15-1-2-17(22)14(9-15)10-16(23)11-19(29)27-7-8-28-18(12-27)25-26-20(28)13-3-5-24-6-4-13/h1-6,9,16H,7-8,10-12,23H2/t16-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210669
PNG
((R)-3-amino-4-(4-chloro-2,5-difluorophenyl)-1-(3-(...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cc(F)c(Cl)cc1F
Show InChI InChI=1S/C16H15ClF5N5O/c17-10-6-11(18)8(4-12(10)19)3-9(23)5-14(28)26-1-2-27-13(7-26)24-25-15(27)16(20,21)22/h4,6,9H,1-3,5,7,23H2/t9-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210671
PNG
((R)-7-(3-amino-4-(2,4,5-trifluorophenyl)butanoyl)-...)
Show SMILES CC(C)(C)NC(=O)c1nnc2CN(CCn12)C(=O)C[C@H](N)Cc1cc(F)c(F)cc1F
Show InChI InChI=1S/C20H25F3N6O2/c1-20(2,3)25-19(31)18-27-26-16-10-28(4-5-29(16)18)17(30)8-12(24)6-11-7-14(22)15(23)9-13(11)21/h7,9,12H,4-6,8,10,24H2,1-3H3,(H,25,31)/t12-/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210653
PNG
((R)-3-amino-1-(3-(trifluoromethyl)-5,6-dihydro-[1,...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1c(F)ccc(F)c1F |r|
Show InChI InChI=1S/C16H15F6N5O/c17-10-1-2-11(18)14(19)9(10)5-8(23)6-13(28)26-3-4-27-12(7-26)24-25-15(27)16(20,21)22/h1-2,8H,3-7,23H2/t8-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210665
PNG
((R)-3-amino-4-(2,4-difluorophenyl)-1-(3-(trifluoro...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccc(F)cc1F
Show InChI InChI=1S/C16H16F5N5O/c17-10-2-1-9(12(18)6-10)5-11(22)7-14(27)25-3-4-26-13(8-25)23-24-15(26)16(19,20)21/h1-2,6,11H,3-5,7-8,22H2/t11-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210654
PNG
((R)-3-amino-4-(perfluorophenyl)-1-(3-(trifluoromet...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1c(F)c(F)c(F)c(F)c1F
Show InChI InChI=1S/C16H13F8N5O/c17-10-7(11(18)13(20)14(21)12(10)19)3-6(25)4-9(30)28-1-2-29-8(5-28)26-27-15(29)16(22,23)24/h6H,1-5,25H2/t6-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210670
PNG
((R)-3-amino-4-(2,5-difluorophenyl)-1-(3-(hydroxyme...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(CO)nnc2C1)Cc1cc(F)ccc1F
Show InChI InChI=1S/C16H19F2N5O2/c17-11-1-2-13(18)10(5-11)6-12(19)7-16(25)22-3-4-23-14(8-22)20-21-15(23)9-24/h1-2,5,12,24H,3-4,6-9,19H2/t12-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210659
PNG
((R)-3-amino-1-(3-(trifluoromethyl)-5,6-dihydro-[1,...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C17H17F6N5O/c18-16(19,20)11-3-1-2-10(6-11)7-12(24)8-14(29)27-4-5-28-13(9-27)25-26-15(28)17(21,22)23/h1-3,6,12H,4-5,7-9,24H2/t12-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210667
PNG
((R)-3-amino-1-(3-(trifluoromethyl)-5,6-dihydro-[1,...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C17H17F6N5O/c18-16(19,20)11-3-1-10(2-4-11)7-12(24)8-14(29)27-5-6-28-13(9-27)25-26-15(28)17(21,22)23/h1-4,12H,5-9,24H2/t12-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210645
PNG
((R)-3-amino-4-(4-fluorophenyl)-1-(3-(trifluorometh...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccc(F)cc1
Show InChI InChI=1S/C16H17F4N5O/c17-11-3-1-10(2-4-11)7-12(21)8-14(26)24-5-6-25-13(9-24)22-23-15(25)16(18,19)20/h1-4,12H,5-9,21H2/t12-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210652
PNG
((R)-3-amino-1-(3-ethyl-5,6-dihydro-[1,2,4]triazolo...)
Show SMILES CCc1nnc2CN(CCn12)C(=O)C[C@H](N)Cc1cc(F)c(F)cc1F |r|
Show InChI InChI=1S/C17H20F3N5O/c1-2-15-22-23-16-9-24(3-4-25(15)16)17(26)7-11(21)5-10-6-13(19)14(20)8-12(10)18/h6,8,11H,2-5,7,9,21H2,1H3/t11-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210658
PNG
((R)-3-amino-1-(3-(trifluoromethyl)-5,6-dihydro-[1,...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1c(F)cc(F)cc1F |r|
Show InChI InChI=1S/C16H15F6N5O/c17-8-3-11(18)10(12(19)4-8)5-9(23)6-14(28)26-1-2-27-13(7-26)24-25-15(27)16(20,21)22/h3-4,9H,1-2,5-7,23H2/t9-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210656
PNG
((R)-3-amino-4-(3,4-dichlorophenyl)-1-(3-(trifluoro...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C16H16Cl2F3N5O/c17-11-2-1-9(6-12(11)18)5-10(22)7-14(27)25-3-4-26-13(8-25)23-24-15(26)16(19,20)21/h1-2,6,10H,3-5,7-8,22H2/t10-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM11159
PNG
((1R)-1-(3,4-difluorobenzyl)-3-oxo-3-[3-(trifluorom...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccc(F)c(F)c1 |r|
Show InChI InChI=1S/C16H16F5N5O/c17-11-2-1-9(6-12(11)18)5-10(22)7-14(27)25-3-4-26-13(8-25)23-24-15(26)16(19,20)21/h1-2,6,10H,3-5,7-8,22H2/t10-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210670
PNG
((R)-3-amino-4-(2,5-difluorophenyl)-1-(3-(hydroxyme...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(CO)nnc2C1)Cc1cc(F)ccc1F
Show InChI InChI=1S/C16H19F2N5O2/c17-11-1-2-13(18)10(5-11)6-12(19)7-16(25)22-3-4-23-14(8-22)20-21-15(23)9-24/h1-2,5,12,24H,3-4,6-9,19H2/t12-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210650
PNG
((R)-3-amino-4-(3-chlorophenyl)-1-(3-(trifluorometh...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cccc(Cl)c1
Show InChI InChI=1S/C16H17ClF3N5O/c17-11-3-1-2-10(6-11)7-12(21)8-14(26)24-4-5-25-13(9-24)22-23-15(25)16(18,19)20/h1-3,6,12H,4-5,7-9,21H2/t12-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210664
PNG
((R)-3-amino-4-(2,5-dichlorophenyl)-1-(3-(trifluoro...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cc(Cl)ccc1Cl
Show InChI InChI=1S/C16H16Cl2F3N5O/c17-10-1-2-12(18)9(5-10)6-11(22)7-14(27)25-3-4-26-13(8-25)23-24-15(26)16(19,20)21/h1-2,5,11H,3-4,6-8,22H2/t11-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210643
PNG
((R)-3-amino-4-(2-chloro-4,5-difluorophenyl)-1-(3-(...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cc(F)c(F)cc1Cl
Show InChI InChI=1S/C16H15ClF5N5O/c17-10-6-12(19)11(18)4-8(10)3-9(23)5-14(28)26-1-2-27-13(7-26)24-25-15(27)16(20,21)22/h4,6,9H,1-3,5,7,23H2/t9-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM11162
PNG
((1R)-3-oxo-3-[3-(trifluoroethyl)-5,6-dihydro[1,2,4...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cc(F)c(F)cc1F |r|
Show InChI InChI=1S/C16H15F6N5O/c17-10-6-12(19)11(18)4-8(10)3-9(23)5-14(28)26-1-2-27-13(7-26)24-25-15(27)16(20,21)22/h4,6,9H,1-3,5,7,23H2/t9-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210659
PNG
((R)-3-amino-1-(3-(trifluoromethyl)-5,6-dihydro-[1,...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C17H17F6N5O/c18-16(19,20)11-3-1-2-10(6-11)7-12(24)8-14(29)27-4-5-28-13(9-27)25-26-15(28)17(21,22)23/h1-3,6,12H,4-5,7-9,24H2/t12-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210662
PNG
((R)-3-amino-4-(3-fluorophenyl)-1-(3-(trifluorometh...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cccc(F)c1
Show InChI InChI=1S/C16H17F4N5O/c17-11-3-1-2-10(6-11)7-12(21)8-14(26)24-4-5-25-13(9-24)22-23-15(25)16(18,19)20/h1-3,6,12H,4-5,7-9,21H2/t12-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210656
PNG
((R)-3-amino-4-(3,4-dichlorophenyl)-1-(3-(trifluoro...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C16H16Cl2F3N5O/c17-11-2-1-9(6-12(11)18)5-10(22)7-14(27)25-3-4-26-13(8-25)23-24-15(26)16(19,20)21/h1-2,6,10H,3-5,7-8,22H2/t10-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210649
PNG
((R)-3-amino-1-(3-(difluoromethyl)-5,6-dihydro-[1,2...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)F)Cc1cc(F)c(F)cc1F
Show InChI InChI=1S/C16H16F5N5O/c17-10-6-12(19)11(18)4-8(10)3-9(22)5-14(27)25-1-2-26-13(7-25)23-24-16(26)15(20)21/h4,6,9,15H,1-3,5,7,22H2/t9-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210644
PNG
((R)-3-amino-1-(3-(trifluoromethyl)-5,6-dihydro-[1,...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccccc1C(F)(F)F
Show InChI InChI=1S/C17H17F6N5O/c18-16(19,20)12-4-2-1-3-10(12)7-11(24)8-14(29)27-5-6-28-13(9-27)25-26-15(28)17(21,22)23/h1-4,11H,5-9,24H2/t11-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210661
PNG
((R)-3-amino-4-(2-chlorophenyl)-1-(3-(trifluorometh...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccccc1Cl
Show InChI InChI=1S/C16H17ClF3N5O/c17-12-4-2-1-3-10(12)7-11(21)8-14(26)24-5-6-25-13(9-24)22-23-15(25)16(18,19)20/h1-4,11H,5-9,21H2/t11-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210662
PNG
((R)-3-amino-4-(3-fluorophenyl)-1-(3-(trifluorometh...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cccc(F)c1
Show InChI InChI=1S/C16H17F4N5O/c17-11-3-1-2-10(6-11)7-12(21)8-14(26)24-4-5-25-13(9-24)22-23-15(25)16(18,19)20/h1-3,6,12H,4-5,7-9,21H2/t12-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210647
PNG
((R)-3-amino-1-(3-cyclopropyl-5,6-dihydro-[1,2,4]tr...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C1CC1)Cc1cc(F)c(F)cc1F
Show InChI InChI=1S/C18H20F3N5O/c19-13-8-15(21)14(20)6-11(13)5-12(22)7-17(27)25-3-4-26-16(9-25)23-24-18(26)10-1-2-10/h6,8,10,12H,1-5,7,9,22H2/t12-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM11160
PNG
((3R)-3-amino-4-(2,5-difluorophenyl)-1-[3-(trifluor...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cc(F)ccc1F |r|
Show InChI InChI=1S/C16H16F5N5O/c17-10-1-2-12(18)9(5-10)6-11(22)7-14(27)25-3-4-26-13(8-25)23-24-15(26)16(19,20)21/h1-2,5,11H,3-4,6-8,22H2/t11-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210664
PNG
((R)-3-amino-4-(2,5-dichlorophenyl)-1-(3-(trifluoro...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cc(Cl)ccc1Cl
Show InChI InChI=1S/C16H16Cl2F3N5O/c17-10-1-2-12(18)9(5-10)6-11(22)7-14(27)25-3-4-26-13(8-25)23-24-15(26)16(19,20)21/h1-2,5,11H,3-4,6-8,22H2/t11-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50210644
PNG
((R)-3-amino-1-(3-(trifluoromethyl)-5,6-dihydro-[1,...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccccc1C(F)(F)F
Show InChI InChI=1S/C17H17F6N5O/c18-16(19,20)12-4-2-1-3-10(12)7-11(24)8-14(29)27-5-6-28-13(9-27)25-26-15(28)17(21,22)23/h1-4,11H,5-9,24H2/t11-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210655
PNG
((R)-3-amino-1-(3-(trifluoromethyl)-5,6-dihydro-[1,...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cc(F)cc(F)c1F |r|
Show InChI InChI=1S/C16H15F6N5O/c17-9-3-8(14(19)11(18)5-9)4-10(23)6-13(28)26-1-2-27-12(7-26)24-25-15(27)16(20,21)22/h3,5,10H,1-2,4,6-7,23H2/t10-/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50210663
PNG
((R)-3-amino-4-(2-fluorophenyl)-1-(3-(trifluorometh...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1ccccc1F |r|
Show InChI InChI=1S/C16H17F4N5O/c17-12-4-2-1-3-10(12)7-11(21)8-14(26)24-5-6-25-13(9-24)22-23-15(25)16(18,19)20/h1-4,11H,5-9,21H2/t11-/m1/s1
PDB

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UniProtKB/SwissProt

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UniChem

Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM15561
PNG
((3R)-3-amino-4-(5-chloro-2-fluorophenyl)-1-[3-(tri...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cc(Cl)ccc1F |r|
Show InChI InChI=1S/C16H16ClF4N5O/c17-10-1-2-12(18)9(5-10)6-11(22)7-14(27)25-3-4-26-13(8-25)23-24-15(26)16(19,20)21/h1-2,5,11H,3-4,6-8,22H2/t11-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%