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PubMed code 17822893

Compile data set for download or QSAR
Found 61 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))
BDBM15494
PNG
(3-{6-[(3R,4S)-3-amino-4-(2,4,5-trifluorophenyl)pyr...)
Show SMILES N[C@H]1CN(C[C@@H]1c1cc(F)c(F)cc1F)c1cc(ncn1)-c1cccc(c1)C(O)=O |r|
Show InChI InChI=1S/C21H17F3N4O2/c22-15-6-17(24)16(23)5-13(15)14-8-28(9-18(14)25)20-7-19(26-10-27-20)11-2-1-3-12(4-11)21(29)30/h1-7,10,14,18H,8-9,25H2,(H,29,30)/t14-,18+/m1/s1
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n/an/a 5n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221102
PNG
(CHEMBL236719 | N-(3-(6-((3R,4S)-3-amino-4-(2,4,5-t...)
Show SMILES CC(=O)Nc1cccc(c1)-c1cc(ncn1)N1C[C@H](N)[C@H](C1)c1cc(F)c(F)cc1F
Show InChI InChI=1S/C22H20F3N5O/c1-12(31)29-14-4-2-3-13(5-14)21-8-22(28-11-27-21)30-9-16(20(26)10-30)15-6-18(24)19(25)7-17(15)23/h2-8,11,16,20H,9-10,26H2,1H3,(H,29,31)/t16-,20+/m1/s1
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n/an/a 14n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221075
PNG
(1-(3-(6-((3R,4S)-3-amino-4-(2,4,5-trifluorophenyl)...)
Show SMILES CC(=O)c1cccc(c1)-c1cc(ncn1)N1C[C@H](N)[C@H](C1)c1cc(F)c(F)cc1F
Show InChI InChI=1S/C22H19F3N4O/c1-12(30)13-3-2-4-14(5-13)21-8-22(28-11-27-21)29-9-16(20(26)10-29)15-6-18(24)19(25)7-17(15)23/h2-8,11,16,20H,9-10,26H2,1H3/t16-,20+/m1/s1
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n/an/a 19n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM15492
PNG
((3R,4S)-1-(6-phenylpyrimidin-4-yl)-4-(2,4,5-triflu...)
Show SMILES N[C@H]1CN(C[C@@H]1c1cc(F)c(F)cc1F)c1cc(ncn1)-c1ccccc1 |r|
Show InChI InChI=1S/C20H17F3N4/c21-15-7-17(23)16(22)6-13(15)14-9-27(10-18(14)24)20-8-19(25-11-26-20)12-4-2-1-3-5-12/h1-8,11,14,18H,9-10,24H2/t14-,18+/m1/s1
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n/an/a 21n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM15492
PNG
((3R,4S)-1-(6-phenylpyrimidin-4-yl)-4-(2,4,5-triflu...)
Show SMILES N[C@H]1CN(C[C@@H]1c1cc(F)c(F)cc1F)c1cc(ncn1)-c1ccccc1 |r|
Show InChI InChI=1S/C20H17F3N4/c21-15-7-17(23)16(22)6-13(15)14-9-27(10-18(14)24)20-8-19(25-11-26-20)12-4-2-1-3-5-12/h1-8,11,14,18H,9-10,24H2/t14-,18+/m1/s1
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n/an/a 21n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221083
PNG
((3R,4S)-1-(6-(pyridin-3-yl)pyrimidin-4-yl)-4-(2,4,...)
Show SMILES N[C@H]1CN(C[C@@H]1c1cc(F)c(F)cc1F)c1cc(ncn1)-c1cccnc1
Show InChI InChI=1S/C19H16F3N5/c20-14-5-16(22)15(21)4-12(14)13-8-27(9-17(13)23)19-6-18(25-10-26-19)11-2-1-3-24-7-11/h1-7,10,13,17H,8-9,23H2/t13-,17+/m1/s1
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n/an/a 31n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221094
PNG
((3-(6-((3R,4S)-3-amino-4-(2,4,5-trifluorophenyl)py...)
Show SMILES N[C@H]1CN(C[C@@H]1c1cc(F)c(F)cc1F)c1cc(ncn1)-c1cccc(CO)c1
Show InChI InChI=1S/C21H19F3N4O/c22-16-6-18(24)17(23)5-14(16)15-8-28(9-19(15)25)21-7-20(26-11-27-21)13-3-1-2-12(4-13)10-29/h1-7,11,15,19,29H,8-10,25H2/t15-,19+/m1/s1
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n/an/a 32n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221073
PNG
((3R,4S)-1-(6-(6-methoxypyridin-3-yl)pyrimidin-4-yl...)
Show SMILES COc1ccc(cn1)-c1cc(ncn1)N1C[C@H](N)[C@H](C1)c1cc(F)c(F)cc1F
Show InChI InChI=1S/C20H18F3N5O/c1-29-20-3-2-11(7-25-20)18-6-19(27-10-26-18)28-8-13(17(24)9-28)12-4-15(22)16(23)5-14(12)21/h2-7,10,13,17H,8-9,24H2,1H3/t13-,17+/m1/s1
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n/an/a 37n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221073
PNG
((3R,4S)-1-(6-(6-methoxypyridin-3-yl)pyrimidin-4-yl...)
Show SMILES COc1ccc(cn1)-c1cc(ncn1)N1C[C@H](N)[C@H](C1)c1cc(F)c(F)cc1F
Show InChI InChI=1S/C20H18F3N5O/c1-29-20-3-2-11(7-25-20)18-6-19(27-10-26-18)28-8-13(17(24)9-28)12-4-15(22)16(23)5-14(12)21/h2-7,10,13,17H,8-9,24H2,1H3/t13-,17+/m1/s1
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n/an/a 37n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221080
PNG
(3-(6-((3R,4S)-3-amino-4-(2,4,5-trifluorophenyl)pyr...)
Show SMILES N[C@H]1CN(C[C@@H]1c1cc(F)c(F)cc1F)c1cc(ncn1)-c1cccc(c1)C#N
Show InChI InChI=1S/C21H16F3N5/c22-16-6-18(24)17(23)5-14(16)15-9-29(10-19(15)26)21-7-20(27-11-28-21)13-3-1-2-12(4-13)8-25/h1-7,11,15,19H,9-10,26H2/t15-,19+/m1/s1
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n/an/a 37n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221104
PNG
((3R,4S)-1-(6-(3-methoxyphenyl)pyrimidin-4-yl)-4-(2...)
Show SMILES COc1cccc(c1)-c1cc(ncn1)N1C[C@H](N)[C@H](C1)c1cc(F)c(F)cc1F
Show InChI InChI=1S/C21H19F3N4O/c1-29-13-4-2-3-12(5-13)20-8-21(27-11-26-20)28-9-15(19(25)10-28)14-6-17(23)18(24)7-16(14)22/h2-8,11,15,19H,9-10,25H2,1H3/t15-,19+/m1/s1
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n/an/a 47n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221085
PNG
((3R,4S)-1-(6-(3-fluorophenyl)pyrimidin-4-yl)-4-(2,...)
Show SMILES N[C@H]1CN(C[C@@H]1c1cc(F)c(F)cc1F)c1cc(ncn1)-c1cccc(F)c1
Show InChI InChI=1S/C20H16F4N4/c21-12-3-1-2-11(4-12)19-7-20(27-10-26-19)28-8-14(18(25)9-28)13-5-16(23)17(24)6-15(13)22/h1-7,10,14,18H,8-9,25H2/t14-,18+/m1/s1
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n/an/a 51n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221101
PNG
((3R,4S)-1-(6-(4-fluorophenyl)pyrimidin-4-yl)-4-(2,...)
Show SMILES N[C@H]1CN(C[C@@H]1c1cc(F)c(F)cc1F)c1cc(ncn1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H16F4N4/c21-12-3-1-11(2-4-12)19-7-20(27-10-26-19)28-8-14(18(25)9-28)13-5-16(23)17(24)6-15(13)22/h1-7,10,14,18H,8-9,25H2/t14-,18+/m1/s1
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n/an/a 51n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221085
PNG
((3R,4S)-1-(6-(3-fluorophenyl)pyrimidin-4-yl)-4-(2,...)
Show SMILES N[C@H]1CN(C[C@@H]1c1cc(F)c(F)cc1F)c1cc(ncn1)-c1cccc(F)c1
Show InChI InChI=1S/C20H16F4N4/c21-12-3-1-2-11(4-12)19-7-20(27-10-26-19)28-8-14(18(25)9-28)13-5-16(23)17(24)6-15(13)22/h1-7,10,14,18H,8-9,25H2/t14-,18+/m1/s1
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n/an/a 51n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221088
PNG
((3R,4S)-1-(6-(2-fluorophenyl)pyrimidin-4-yl)-4-(2,...)
Show SMILES N[C@H]1CN(C[C@@H]1c1cc(F)c(F)cc1F)c1cc(ncn1)-c1ccccc1F
Show InChI InChI=1S/C20H16F4N4/c21-14-4-2-1-3-11(14)19-7-20(27-10-26-19)28-8-13(18(25)9-28)12-5-16(23)17(24)6-15(12)22/h1-7,10,13,18H,8-9,25H2/t13-,18+/m1/s1
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n/an/a 57n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221074
PNG
(3-(6-((3R,4S)-3-amino-4-(2,4,5-trifluorophenyl)pyr...)
Show SMILES N[C@H]1CN(C[C@@H]1c1cc(F)c(F)cc1F)c1cc(ncn1)-c1cccc(O)c1
Show InChI InChI=1S/C20H17F3N4O/c21-15-6-17(23)16(22)5-13(15)14-8-27(9-18(14)24)20-7-19(25-10-26-20)11-2-1-3-12(28)4-11/h1-7,10,14,18,28H,8-9,24H2/t14-,18+/m1/s1
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n/an/a 70n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221082
PNG
((3R,4S)-1-(6-(3-(trifluoromethyl)phenyl)pyrimidin-...)
Show SMILES N[C@H]1CN(C[C@@H]1c1cc(F)c(F)cc1F)c1cc(ncn1)-c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C21H16F6N4/c22-15-6-17(24)16(23)5-13(15)14-8-31(9-18(14)28)20-7-19(29-10-30-20)11-2-1-3-12(4-11)21(25,26)27/h1-7,10,14,18H,8-9,28H2/t14-,18+/m1/s1
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n/an/a 71n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221098
PNG
(2-(6-((3R,4S)-3-amino-4-(2,4,5-trifluorophenyl)pyr...)
Show SMILES N[C@H]1CN(C[C@@H]1c1cc(F)c(F)cc1F)c1cc(ncn1)-c1ccccc1C#N
Show InChI InChI=1S/C21H16F3N5/c22-16-6-18(24)17(23)5-14(16)15-9-29(10-19(15)26)21-7-20(27-11-28-21)13-4-2-1-3-12(13)8-25/h1-7,11,15,19H,9-10,26H2/t15-,19+/m1/s1
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n/an/a 93n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221086
PNG
((3R,4S)-1-(6-(4-methoxyphenyl)pyrimidin-4-yl)-4-(2...)
Show SMILES COc1ccc(cc1)-c1cc(ncn1)N1C[C@H](N)[C@H](C1)c1cc(F)c(F)cc1F
Show InChI InChI=1S/C21H19F3N4O/c1-29-13-4-2-12(3-5-13)20-8-21(27-11-26-20)28-9-15(19(25)10-28)14-6-17(23)18(24)7-16(14)22/h2-8,11,15,19H,9-10,25H2,1H3/t15-,19+/m1/s1
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n/an/a 120n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221099
PNG
((3R,4S)-1-(6-(3-nitrophenyl)pyrimidin-4-yl)-4-(2,4...)
Show SMILES N[C@H]1CN(C[C@@H]1c1cc(F)c(F)cc1F)c1cc(ncn1)-c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C20H16F3N5O2/c21-15-6-17(23)16(22)5-13(15)14-8-27(9-18(14)24)20-7-19(25-10-26-20)11-2-1-3-12(4-11)28(29)30/h1-7,10,14,18H,8-9,24H2/t14-,18+/m1/s1
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n/an/a 120n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221077
PNG
(4-(6-((3R,4S)-3-amino-4-(2,4,5-trifluorophenyl)pyr...)
Show SMILES N[C@H]1CN(C[C@@H]1c1cc(F)c(F)cc1F)c1cc(ncn1)-c1ccc(cc1)C#N
Show InChI InChI=1S/C21H16F3N5/c22-16-6-18(24)17(23)5-14(16)15-9-29(10-19(15)26)21-7-20(27-11-28-21)13-3-1-12(8-25)2-4-13/h1-7,11,15,19H,9-10,26H2/t15-,19+/m1/s1
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n/an/a 130n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221078
PNG
(CHEMBL236507 | trans-7-[3-amino-4-(4-fluoro-phenyl...)
Show SMILES N[C@H]1CN(C[C@H]1c1ccc(F)cc1)c1nc2n(cc(C(O)=O)c(=O)c2cc1F)C1CC1 |r|
Show InChI InChI=1S/C22H20F2N4O3/c23-12-3-1-11(2-4-12)15-8-27(10-18(15)25)21-17(24)7-14-19(29)16(22(30)31)9-28(13-5-6-13)20(14)26-21/h1-4,7,9,13,15,18H,5-6,8,10,25H2,(H,30,31)/t15-,18-/m0/s1
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n/an/a 140n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221090
PNG
(CHEMBL237568 | trans-7-(3-Amino-4-phenyl-pyrrolidi...)
Show SMILES N[C@H]1CN(C[C@H]1c1ccccc1)c1nc2n(cc(C(O)=O)c(=O)c2cc1F)C1CC1 |r|
Show InChI InChI=1S/C22H21FN4O3/c23-17-8-14-19(28)16(22(29)30)10-27(13-6-7-13)20(14)25-21(17)26-9-15(18(24)11-26)12-4-2-1-3-5-12/h1-5,8,10,13,15,18H,6-7,9,11,24H2,(H,29,30)/t15-,18-/m0/s1
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n/an/a 150n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221095
PNG
(1-(4-(6-((3R,4S)-3-amino-4-(2,4,5-trifluorophenyl)...)
Show SMILES CC(=O)c1ccc(cc1)-c1cc(ncn1)N1C[C@H](N)[C@H](C1)c1cc(F)c(F)cc1F
Show InChI InChI=1S/C22H19F3N4O/c1-12(30)13-2-4-14(5-3-13)21-8-22(28-11-27-21)29-9-16(20(26)10-29)15-6-18(24)19(25)7-17(15)23/h2-8,11,16,20H,9-10,26H2,1H3/t16-,20+/m1/s1
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n/an/a 160n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221081
PNG
((3R,4S)-1-(6-(2-methoxyphenyl)pyrimidin-4-yl)-4-(2...)
Show SMILES COc1ccccc1-c1cc(ncn1)N1C[C@H](N)[C@H](C1)c1cc(F)c(F)cc1F
Show InChI InChI=1S/C21H19F3N4O/c1-29-20-5-3-2-4-12(20)19-8-21(27-11-26-19)28-9-14(18(25)10-28)13-6-16(23)17(24)7-15(13)22/h2-8,11,14,18H,9-10,25H2,1H3/t14-,18+/m1/s1
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n/an/a 180n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221097
PNG
((3R,4S)-1-(6-(3-chlorophenyl)pyrimidin-4-yl)-4-(2,...)
Show SMILES N[C@H]1CN(C[C@@H]1c1cc(F)c(F)cc1F)c1cc(ncn1)-c1cccc(Cl)c1
Show InChI InChI=1S/C20H16ClF3N4/c21-12-3-1-2-11(4-12)19-7-20(27-10-26-19)28-8-14(18(25)9-28)13-5-16(23)17(24)6-15(13)22/h1-7,10,14,18H,8-9,25H2/t14-,18+/m1/s1
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n/an/a 190n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221096
PNG
(CHEMBL438309 | trans-7-[3-Amino-4-(2-methoxy-pheny...)
Show SMILES COc1ccccc1[C@@H]1CN(C[C@@H]1N)c1nc2n(cc(C(O)=O)c(=O)c2cc1F)C1CC1 |r|
Show InChI InChI=1S/C23H23FN4O4/c1-32-19-5-3-2-4-13(19)15-9-27(11-18(15)25)22-17(24)8-14-20(29)16(23(30)31)10-28(12-6-7-12)21(14)26-22/h2-5,8,10,12,15,18H,6-7,9,11,25H2,1H3,(H,30,31)/t15-,18-/m0/s1
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n/an/a 200n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221084
PNG
(1-(2-(6-((3R,4S)-3-amino-4-(2,4,5-trifluorophenyl)...)
Show SMILES CC(=O)c1ccccc1-c1cc(ncn1)N1C[C@H](N)[C@H](C1)c1cc(F)c(F)cc1F
Show InChI InChI=1S/C22H19F3N4O/c1-12(30)13-4-2-3-5-14(13)21-8-22(28-11-27-21)29-9-16(20(26)10-29)15-6-18(24)19(25)7-17(15)23/h2-8,11,16,20H,9-10,26H2,1H3/t16-,20+/m1/s1
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n/an/a 230n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221087
PNG
((3R,4S)-1-(6-(2-chlorophenyl)pyrimidin-4-yl)-4-(2,...)
Show SMILES N[C@H]1CN(C[C@@H]1c1cc(F)c(F)cc1F)c1cc(ncn1)-c1ccccc1Cl
Show InChI InChI=1S/C20H16ClF3N4/c21-14-4-2-1-3-11(14)19-7-20(27-10-26-19)28-8-13(18(25)9-28)12-5-16(23)17(24)6-15(12)22/h1-7,10,13,18H,8-9,25H2/t13-,18+/m1/s1
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n/an/a 260n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221093
PNG
((3R,4S)-1-(6-(4-chlorophenyl)pyrimidin-4-yl)-4-(2,...)
Show SMILES N[C@H]1CN(C[C@@H]1c1cc(F)c(F)cc1F)c1cc(ncn1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C20H16ClF3N4/c21-12-3-1-11(2-4-12)19-7-20(27-10-26-19)28-8-14(18(25)9-28)13-5-16(23)17(24)6-15(13)22/h1-7,10,14,18H,8-9,25H2/t14-,18+/m1/s1
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n/an/a 470n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221092
PNG
((3R,4S)-4-phenyl-1-(6-phenylpyrimidin-4-yl)pyrroli...)
Show SMILES N[C@H]1CN(C[C@@H]1c1ccccc1)c1cc(ncn1)-c1ccccc1
Show InChI InChI=1S/C20H20N4/c21-18-13-24(12-17(18)15-7-3-1-4-8-15)20-11-19(22-14-23-20)16-9-5-2-6-10-16/h1-11,14,17-18H,12-13,21H2/t17-,18+/m1/s1
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n/an/a 790n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221076
PNG
(CHEMBL399409 | trans-7-[3-amino-4-(3,4-dichloro-ph...)
Show SMILES N[C@H]1CN(C[C@H]1c1ccc(Cl)c(Cl)c1)c1nc2n(cc(C(O)=O)c(=O)c2cc1F)C1CC1 |r|
Show InChI InChI=1S/C22H19Cl2FN4O3/c23-15-4-1-10(5-16(15)24)13-7-28(9-18(13)26)21-17(25)6-12-19(30)14(22(31)32)8-29(11-2-3-11)20(12)27-21/h1,4-6,8,11,13,18H,2-3,7,9,26H2,(H,31,32)/t13-,18-/m0/s1
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n/an/a 1.00E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221103
PNG
((3R,4S)-1-(6-(3-(trifluoromethoxy)phenyl)pyrimidin...)
Show SMILES N[C@H]1CN(C[C@@H]1c1cc(F)c(F)cc1F)c1cc(ncn1)-c1cccc(OC(F)(F)F)c1
Show InChI InChI=1S/C21H16F6N4O/c22-15-6-17(24)16(23)5-13(15)14-8-31(9-18(14)28)20-7-19(29-10-30-20)11-2-1-3-12(4-11)32-21(25,26)27/h1-7,10,14,18H,8-9,28H2/t14-,18+/m1/s1
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n/an/a 1.30E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221089
PNG
(3-(6-((3R,4S)-3-amino-4-phenylpyrrolidin-1-yl)pyri...)
Show SMILES N[C@H]1CN(C[C@@H]1c1ccccc1)c1cc(ncn1)-c1cccc(c1)C#N
Show InChI InChI=1S/C21H19N5/c22-11-15-5-4-8-17(9-15)20-10-21(25-14-24-20)26-12-18(19(23)13-26)16-6-2-1-3-7-16/h1-10,14,18-19H,12-13,23H2/t18-,19+/m1/s1
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n/an/a 1.40E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50221085
PNG
((3R,4S)-1-(6-(3-fluorophenyl)pyrimidin-4-yl)-4-(2,...)
Show SMILES N[C@H]1CN(C[C@@H]1c1cc(F)c(F)cc1F)c1cc(ncn1)-c1cccc(F)c1
Show InChI InChI=1S/C20H16F4N4/c21-12-3-1-2-11(4-12)19-7-20(27-10-26-19)28-8-14(18(25)9-28)13-5-16(23)17(24)6-15(13)22/h1-7,10,14,18H,8-9,25H2/t14-,18+/m1/s1
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n/an/a 1.60E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP8


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221079
PNG
(CHEMBL237567 | cis-7-[3-amino-4-(2-methoxy-phenyl)...)
Show SMILES COc1ccccc1[C@H]1CN(C[C@@H]1N)c1nc2n(cc(C(O)=O)c(=O)c2cc1F)C1CC1 |r|
Show InChI InChI=1S/C23H23FN4O4/c1-32-19-5-3-2-4-13(19)15-9-27(11-18(15)25)22-17(24)8-14-20(29)16(23(30)31)10-28(12-6-7-12)21(14)26-22/h2-5,8,10,12,15,18H,6-7,9,11,25H2,1H3,(H,30,31)/t15-,18+/m1/s1
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n/an/a 2.00E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221091
PNG
((3R,4S)-1-(6-(4-methoxyphenyl)pyrimidin-4-yl)-4-ph...)
Show SMILES COc1ccc(cc1)-c1cc(ncn1)N1C[C@H](N)[C@H](C1)c1ccccc1
Show InChI InChI=1S/C21H22N4O/c1-26-17-9-7-16(8-10-17)20-11-21(24-14-23-20)25-12-18(19(22)13-25)15-5-3-2-4-6-15/h2-11,14,18-19H,12-13,22H2,1H3/t18-,19+/m1/s1
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n/an/a 2.30E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50221100
PNG
((3R,4S)-1-(6-(3-chlorophenyl)pyrimidin-4-yl)-4-phe...)
Show SMILES N[C@H]1CN(C[C@@H]1c1ccccc1)c1cc(ncn1)-c1cccc(Cl)c1
Show InChI InChI=1S/C20H19ClN4/c21-16-8-4-7-15(9-16)19-10-20(24-13-23-19)25-11-17(18(22)12-25)14-5-2-1-3-6-14/h1-10,13,17-18H,11-12,22H2/t17-,18+/m1/s1
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n/an/a 2.90E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50371188
PNG
(CHEMBL234986)
Show SMILES N[C@H]1CN(C[C@@H]1c1ccccc1)c1cnc2ccccc2n1
Show InChI InChI=1S/C18H18N4/c19-15-12-22(11-14(15)13-6-2-1-3-7-13)18-10-20-16-8-4-5-9-17(16)21-18/h1-10,14-15H,11-12,19H2/t14-,15+/m1/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50371182
PNG
(CHEMBL235420)
Show SMILES N[C@H]1CN(C[C@@H]1c1ccccc1)c1cc(ncn1)-c1ccccc1Cl
Show InChI InChI=1S/C20H19ClN4/c21-17-9-5-4-8-15(17)19-10-20(24-13-23-19)25-11-16(18(22)12-25)14-6-2-1-3-7-14/h1-10,13,16,18H,11-12,22H2/t16-,18+/m1/s1
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n/an/a>3.00E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50371178
PNG
(CHEMBL237140)
Show SMILES COc1ccc(cc1)[C@@H]1CN(C[C@@H]1N)c1nc2n(cc(C(O)=O)c(=O)c2cc1F)C1CC1 |r|
Show InChI InChI=1S/C23H23FN4O4/c1-32-14-6-2-12(3-7-14)16-9-27(11-19(16)25)22-18(24)8-15-20(29)17(23(30)31)10-28(13-4-5-13)21(15)26-22/h2-3,6-8,10,13,16,19H,4-5,9,11,25H2,1H3,(H,30,31)/t16-,19-/m0/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50371177
PNG
(CHEMBL236935)
Show SMILES COC(=O)c1ccc(cc1)[C@@H]1CN(C[C@@H]1N)c1nc2n(cc(C(O)=O)c(=O)c2cc1F)C1CC1 |r|
Show InChI InChI=1S/C24H23FN4O5/c1-34-24(33)13-4-2-12(3-5-13)16-9-28(11-19(16)26)22-18(25)8-15-20(30)17(23(31)32)10-29(14-6-7-14)21(15)27-22/h2-5,8,10,14,16,19H,6-7,9,11,26H2,1H3,(H,31,32)/t16-,19-/m0/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM15492
PNG
((3R,4S)-1-(6-phenylpyrimidin-4-yl)-4-(2,4,5-triflu...)
Show SMILES N[C@H]1CN(C[C@@H]1c1cc(F)c(F)cc1F)c1cc(ncn1)-c1ccccc1 |r|
Show InChI InChI=1S/C20H17F3N4/c21-15-7-17(23)16(22)6-13(15)14-9-27(10-18(14)24)20-8-19(25-11-26-20)12-4-2-1-3-5-12/h1-8,11,14,18H,9-10,24H2/t14-,18+/m1/s1
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n/an/a 3.00E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP8


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50371189
PNG
(CHEMBL234987)
Show SMILES N[C@H]1CN(C[C@@H]1c1ccccc1)c1ccc2ccccc2n1
Show InChI InChI=1S/C19H19N3/c20-17-13-22(12-16(17)14-6-2-1-3-7-14)19-11-10-15-8-4-5-9-18(15)21-19/h1-11,16-17H,12-13,20H2/t16-,17+/m1/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50371185
PNG
(CHEMBL238202)
Show SMILES N[C@H]1CN(C[C@@H]1c1ccccc1)c1cc(ncn1)-c1ccc(O)cc1
Show InChI InChI=1S/C20H20N4O/c21-18-12-24(11-17(18)14-4-2-1-3-5-14)20-10-19(22-13-23-20)15-6-8-16(25)9-7-15/h1-10,13,17-18,25H,11-12,21H2/t17-,18+/m1/s1
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n/an/a>3.00E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50371183
PNG
(CHEMBL392698)
Show SMILES N[C@H]1CN(C[C@@H]1c1ccccc1)c1cc(Cl)nc(n1)-c1ccccc1
Show InChI InChI=1S/C20H19ClN4/c21-18-11-19(24-20(23-18)15-9-5-2-6-10-15)25-12-16(17(22)13-25)14-7-3-1-4-8-14/h1-11,16-17H,12-13,22H2/t16-,17+/m1/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50371186
PNG
(CHEMBL392907)
Show SMILES N[C@H]1CN(C[C@@H]1c1ccccc1)c1cc(ncn1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C20H19ClN4/c21-16-8-6-15(7-9-16)19-10-20(24-13-23-19)25-11-17(18(22)12-25)14-4-2-1-3-5-14/h1-10,13,17-18H,11-12,22H2/t17-,18+/m1/s1
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n/an/a>3.00E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50371175
PNG
(CHEMBL401229)
Show SMILES N[C@H]1CN(C[C@H]1c1ccc(N)cc1)c1nc2n(cc(C(O)=O)c(=O)c2cc1F)C1CC1 |r|
Show InChI InChI=1S/C22H22FN5O3/c23-17-7-14-19(29)16(22(30)31)9-28(13-5-6-13)20(14)26-21(17)27-8-15(18(25)10-27)11-1-3-12(24)4-2-11/h1-4,7,9,13,15,18H,5-6,8,10,24-25H2,(H,30,31)/t15-,18-/m0/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50371187
PNG
(CHEMBL398101)
Show SMILES CC(=O)c1ccc(nc1)N1C[C@H](N)[C@H](C1)c1ccccc1
Show InChI InChI=1S/C17H19N3O/c1-12(21)14-7-8-17(19-9-14)20-10-15(16(18)11-20)13-5-3-2-4-6-13/h2-9,15-16H,10-11,18H2,1H3/t15-,16+/m1/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50371176
PNG
(CHEMBL236934)
Show SMILES CC(C)c1ccc(cc1)[C@@H]1CN(C[C@@H]1N)c1nc2n(cc(C(O)=O)c(=O)c2cc1F)C1CC1 |r|
Show InChI InChI=1S/C25H27FN4O3/c1-13(2)14-3-5-15(6-4-14)18-10-29(12-21(18)27)24-20(26)9-17-22(31)19(25(32)33)11-30(16-7-8-16)23(17)28-24/h3-6,9,11,13,16,18,21H,7-8,10,12,27H2,1-2H3,(H,32,33)/t18-,21-/m0/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50371179
PNG
(CHEMBL237141)
Show SMILES CN(C)c1ccc(cc1)[C@@H]1CN(C[C@@H]1N)c1nc2n(cc(C(O)=O)c(=O)c2cc1F)C1CC1 |r|
Show InChI InChI=1S/C24H26FN5O3/c1-28(2)14-5-3-13(4-6-14)17-10-29(12-20(17)26)23-19(25)9-16-21(31)18(24(32)33)11-30(15-7-8-15)22(16)27-23/h3-6,9,11,15,17,20H,7-8,10,12,26H2,1-2H3,(H,32,33)/t17-,20-/m0/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50371180
PNG
(CHEMBL237357)
Show SMILES N[C@H]1CN(C[C@H]1c1ccc(O)cc1)c1nc2n(cc(C(O)=O)c(=O)c2cc1F)C1CC1 |r|
Show InChI InChI=1S/C22H21FN4O4/c23-17-7-14-19(29)16(22(30)31)9-27(12-3-4-12)20(14)25-21(17)26-8-15(18(24)10-26)11-1-5-13(28)6-2-11/h1-2,5-7,9,12,15,18,28H,3-4,8,10,24H2,(H,30,31)/t15-,18-/m0/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50371184
PNG
(CHEMBL238201)
Show SMILES Cn1cnc2c(ncnc12)N1C[C@H](N)[C@H](C1)c1ccccc1
Show InChI InChI=1S/C16H18N6/c1-21-10-20-14-15(21)18-9-19-16(14)22-7-12(13(17)8-22)11-5-3-2-4-6-11/h2-6,9-10,12-13H,7-8,17H2,1H3/t12-,13+/m1/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50371181
PNG
(CHEMBL235202)
Show SMILES N[C@H]1CN(C[C@@H]1c1ccccc1)c1ncccc1C#N
Show InChI InChI=1S/C16H16N4/c17-9-13-7-4-8-19-16(13)20-10-14(15(18)11-20)12-5-2-1-3-6-12/h1-8,14-15H,10-11,18H2/t14-,15+/m1/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50221073
PNG
((3R,4S)-1-(6-(6-methoxypyridin-3-yl)pyrimidin-4-yl...)
Show SMILES COc1ccc(cn1)-c1cc(ncn1)N1C[C@H](N)[C@H](C1)c1cc(F)c(F)cc1F
Show InChI InChI=1S/C20H18F3N5O/c1-29-20-3-2-11(7-25-20)18-6-19(27-10-26-18)28-8-13(17(24)9-28)12-4-15(22)16(23)5-14(12)21/h2-7,10,13,17H,8-9,24H2,1H3/t13-,17+/m1/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP8


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2


(Homo sapiens (Human))
BDBM50221085
PNG
((3R,4S)-1-(6-(3-fluorophenyl)pyrimidin-4-yl)-4-(2,...)
Show SMILES N[C@H]1CN(C[C@@H]1c1cc(F)c(F)cc1F)c1cc(ncn1)-c1cccc(F)c1
Show InChI InChI=1S/C20H16F4N4/c21-12-3-1-2-11(4-12)19-7-20(27-10-26-19)28-8-14(18(25)9-28)13-5-16(23)17(24)6-15(13)22/h1-7,10,14,18H,8-9,25H2/t14-,18+/m1/s1
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n/an/a 1.50E+4n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP2


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2


(Homo sapiens (Human))
BDBM15492
PNG
((3R,4S)-1-(6-phenylpyrimidin-4-yl)-4-(2,4,5-triflu...)
Show SMILES N[C@H]1CN(C[C@@H]1c1cc(F)c(F)cc1F)c1cc(ncn1)-c1ccccc1 |r|
Show InChI InChI=1S/C20H17F3N4/c21-15-7-17(23)16(22)6-13(15)14-9-27(10-18(14)24)20-8-19(25-11-26-20)12-4-2-1-3-5-12/h1-8,11,14,18H,9-10,24H2/t14-,18+/m1/s1
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n/an/a 1.80E+4n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP2


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2


(Homo sapiens (Human))
BDBM50221073
PNG
((3R,4S)-1-(6-(6-methoxypyridin-3-yl)pyrimidin-4-yl...)
Show SMILES COc1ccc(cn1)-c1cc(ncn1)N1C[C@H](N)[C@H](C1)c1cc(F)c(F)cc1F
Show InChI InChI=1S/C20H18F3N5O/c1-29-20-3-2-11(7-25-20)18-6-19(27-10-26-18)28-8-13(17(24)9-28)12-4-15(22)16(23)5-14(12)21/h2-7,10,13,17H,8-9,24H2,1H3/t13-,17+/m1/s1
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n/an/a 1.90E+4n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP2


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 3


(Homo sapiens (Human))
BDBM50221073
PNG
((3R,4S)-1-(6-(6-methoxypyridin-3-yl)pyrimidin-4-yl...)
Show SMILES COc1ccc(cn1)-c1cc(ncn1)N1C[C@H](N)[C@H](C1)c1cc(F)c(F)cc1F
Show InChI InChI=1S/C20H18F3N5O/c1-29-20-3-2-11(7-25-20)18-6-19(27-10-26-18)28-8-13(17(24)9-28)12-4-15(22)16(23)5-14(12)21/h2-7,10,13,17H,8-9,24H2,1H3/t13-,17+/m1/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP3


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50221073
PNG
((3R,4S)-1-(6-(6-methoxypyridin-3-yl)pyrimidin-4-yl...)
Show SMILES COc1ccc(cn1)-c1cc(ncn1)N1C[C@H](N)[C@H](C1)c1cc(F)c(F)cc1F
Show InChI InChI=1S/C20H18F3N5O/c1-29-20-3-2-11(7-25-20)18-6-19(27-10-26-18)28-8-13(17(24)9-28)12-4-15(22)16(23)5-14(12)21/h2-7,10,13,17H,8-9,24H2,1H3/t13-,17+/m1/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP9


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
Prolyl endopeptidase FAP


(Homo sapiens (Human))
BDBM50221073
PNG
((3R,4S)-1-(6-(6-methoxypyridin-3-yl)pyrimidin-4-yl...)
Show SMILES COc1ccc(cn1)-c1cc(ncn1)N1C[C@H](N)[C@H](C1)c1cc(F)c(F)cc1F
Show InChI InChI=1S/C20H18F3N5O/c1-29-20-3-2-11(7-25-20)18-6-19(27-10-26-18)28-8-13(17(24)9-28)12-4-15(22)16(23)5-14(12)21/h2-7,10,13,17H,8-9,24H2,1H3/t13-,17+/m1/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of FAP


Bioorg Med Chem Lett 17: 5638-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.081
BindingDB Entry DOI: 10.7270/Q2319WRX
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%