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PubMed code 16722626

Compile data set for download or QSAR
Found 94 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 IV


(Rattus norvegicus (rat))
BDBM50187266
PNG
((2R,5S)-1-(2-(1-(hydroxymethyl)cyclopentylamino)ac...)
Show SMILES OCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C14H20N4O2/c15-7-11-3-4-12(8-16)18(11)13(20)9-17-14(10-19)5-1-2-6-14/h11-12,17,19H,1-6,9-10H2/t11-,12+
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n/an/a 38n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP4 in Sprague-Dawley rat plasma


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187283
PNG
((2R,5S)-1-(2-(1-(ethoxymethyl)cyclopentylamino)ace...)
Show SMILES CCOCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C16H24N4O2/c1-2-22-12-16(7-3-4-8-16)19-11-15(21)20-13(9-17)5-6-14(20)10-18/h13-14,19H,2-8,11-12H2,1H3/t13-,14+
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n/an/a 64n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187266
PNG
((2R,5S)-1-(2-(1-(hydroxymethyl)cyclopentylamino)ac...)
Show SMILES OCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C14H20N4O2/c15-7-11-3-4-12(8-16)18(11)13(20)9-17-14(10-19)5-1-2-6-14/h11-12,17,19H,1-6,9-10H2/t11-,12+
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n/an/a 69n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP4 in beagle dog plasma


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187258
PNG
((2S,5R)-1-[2-(hexahydro-2,5-methano-pentalen-3a-yl...)
Show SMILES O=C(CNC12CC3CC1CC(C2)C3)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C17H22N4O/c18-8-14-1-2-15(9-19)21(14)16(22)10-20-17-6-11-3-12(7-17)5-13(17)4-11/h11-15,20H,1-7,10H2/t11?,12?,13?,14-,15+,17?
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n/an/a 72n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187263
PNG
((2S,5R)-1-[2-(3-hydroxy-adamantan-1-ylamino)-acety...)
Show SMILES OC12CC3CC(C1)CC(C3)(C2)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C18H24N4O2/c19-8-14-1-2-15(9-20)22(14)16(23)10-21-17-4-12-3-13(5-17)7-18(24,6-12)11-17/h12-15,21,24H,1-7,10-11H2/t12?,13?,14-,15+,17?,18?
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n/an/a 74n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187275
PNG
((2R,5S)-1-(2-(1-(methoxymethyl)cyclopentylamino)ac...)
Show SMILES COCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C15H22N4O2/c1-21-11-15(6-2-3-7-15)18-10-14(20)19-12(8-16)4-5-13(19)9-17/h12-13,18H,2-7,10-11H2,1H3/t12-,13+
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n/an/a 84n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187261
PNG
((2R,5S)-1-(2-(1-(butoxymethyl)cyclopentylamino)ace...)
Show SMILES CCCCOCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C18H28N4O2/c1-2-3-10-24-14-18(8-4-5-9-18)21-13-17(23)22-15(11-19)6-7-16(22)12-20/h15-16,21H,2-10,13-14H2,1H3/t15-,16+
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n/an/a 91n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187266
PNG
((2R,5S)-1-(2-(1-(hydroxymethyl)cyclopentylamino)ac...)
Show SMILES OCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C14H20N4O2/c15-7-11-3-4-12(8-16)18(11)13(20)9-17-14(10-19)5-1-2-6-14/h11-12,17,19H,1-6,9-10H2/t11-,12+
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n/an/a 92n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP4 in cynomolgus monkey plasma


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187266
PNG
((2R,5S)-1-(2-(1-(hydroxymethyl)cyclopentylamino)ac...)
Show SMILES OCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C14H20N4O2/c15-7-11-3-4-12(8-16)18(11)13(20)9-17-14(10-19)5-1-2-6-14/h11-12,17,19H,1-6,9-10H2/t11-,12+
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n/an/a 104n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187268
PNG
((2S,5R)-1-[2-(adamantan-1-ylamino)-acetyl]-pyrroli...)
Show SMILES O=C(CNC12CC3CC(CC(C3)C1)C2)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C18H24N4O/c19-9-15-1-2-16(10-20)22(15)17(23)11-21-18-6-12-3-13(7-18)5-14(4-12)8-18/h12-16,21H,1-8,11H2/t12?,13?,14?,15-,16+,18?
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n/an/a 106n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187266
PNG
((2R,5S)-1-(2-(1-(hydroxymethyl)cyclopentylamino)ac...)
Show SMILES OCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C14H20N4O2/c15-7-11-3-4-12(8-16)18(11)13(20)9-17-14(10-19)5-1-2-6-14/h11-12,17,19H,1-6,9-10H2/t11-,12+
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n/an/a 109n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP4 in beagle dog plasma


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187294
PNG
((2R,5S)-1-(2-(1-(propoxymethyl)cyclopentylamino)ac...)
Show SMILES CCCOCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C17H26N4O2/c1-2-9-23-13-17(7-3-4-8-17)20-12-16(22)21-14(10-18)5-6-15(21)11-19/h14-15,20H,2-9,12-13H2,1H3/t14-,15+
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n/an/a 123n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187305
PNG
((2R,5S)-1-(2-(1-phenylcyclobutylamino)acetyl)pyrro...)
Show SMILES O=C(CNC1(CCC1)c1ccccc1)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C18H20N4O/c19-11-15-7-8-16(12-20)22(15)17(23)13-21-18(9-4-10-18)14-5-2-1-3-6-14/h1-3,5-6,15-16,21H,4,7-10,13H2/t15-,16+
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n/an/a 164n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187271
PNG
((2R,5S)-1-(2-(1-methylcyclopentylamino)acetyl)pyrr...)
Show SMILES CC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C14H20N4O/c1-14(6-2-3-7-14)17-10-13(19)18-11(8-15)4-5-12(18)9-16/h11-12,17H,2-7,10H2,1H3/t11-,12+
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n/an/a 201n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187265
PNG
((2R,5S)-1-(2-(2,4,4-trimethylpentan-2-ylamino)acet...)
Show SMILES CC(C)(C)CC(C)(C)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C16H26N4O/c1-15(2,3)11-16(4,5)19-10-14(21)20-12(8-17)6-7-13(20)9-18/h12-13,19H,6-7,10-11H2,1-5H3/t12-,13+
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n/an/a 208n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187274
PNG
(CHEMBL211024 | exo-(2R,5S)-1-(2-(bicyclo[2.2.1]hep...)
Show SMILES O=C(CN[C@H]1C[C@@H]2CC[C@H]1C2)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C15H20N4O/c16-7-12-3-4-13(8-17)19(12)15(20)9-18-14-6-10-1-2-11(14)5-10/h10-14,18H,1-6,9H2/t10-,11+,12-,13+,14+/m1/s1
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n/an/a 237n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187276
PNG
((2R,5S)-1-(2-(2-phenylpropan-2-ylamino)acetyl)pyrr...)
Show SMILES CC(C)(NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N)c1ccccc1
Show InChI InChI=1S/C17H20N4O/c1-17(2,13-6-4-3-5-7-13)20-12-16(22)21-14(10-18)8-9-15(21)11-19/h3-7,14-15,20H,8-9,12H2,1-2H3/t14-,15+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187269
PNG
((2R,5S)-1-(2-(1-(isobutoxymethyl)cyclopentylamino)...)
Show SMILES CC(C)COCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C18H28N4O2/c1-14(2)12-24-13-18(7-3-4-8-18)21-11-17(23)22-15(9-19)5-6-16(22)10-20/h14-16,21H,3-8,11-13H2,1-2H3/t15-,16+
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n/an/a 454n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187260
PNG
((2R,5S)-1-(2-(1-(4-fluorophenyl)-2-methylpropan-2-...)
Show SMILES CC(C)(Cc1ccc(F)cc1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C18H21FN4O/c1-18(2,9-13-3-5-14(19)6-4-13)22-12-17(24)23-15(10-20)7-8-16(23)11-21/h3-6,15-16,22H,7-9,12H2,1-2H3/t15-,16+
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n/an/a 651n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187279
PNG
((2R,5S)-1-(2-(tert-butylamino)acetyl)pyrrolidine-2...)
Show SMILES CC(C)(C)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C12H18N4O/c1-12(2,3)15-8-11(17)16-9(6-13)4-5-10(16)7-14/h9-10,15H,4-5,8H2,1-3H3/t9-,10+
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n/an/a 663n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187273
PNG
((2R,5S)-1-(2-(1-(hydroxymethyl)cyclohexylamino)ace...)
Show SMILES OCC1(CCCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C15H22N4O2/c16-8-12-4-5-13(9-17)19(12)14(21)10-18-15(11-20)6-2-1-3-7-15/h12-13,18,20H,1-7,10-11H2/t12-,13+
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n/an/a 687n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187280
PNG
((2R,5S)-1-(2-(1-methylcyclohexylamino)acetyl)pyrro...)
Show SMILES CC1(CCCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C15H22N4O/c1-15(7-3-2-4-8-15)18-11-14(20)19-12(9-16)5-6-13(19)10-17/h12-13,18H,2-8,11H2,1H3/t12-,13+
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n/an/a 689n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187298
PNG
((2R,5S)-1-(2-(1-(cyclohexyloxymethyl)cyclopentylam...)
Show SMILES O=C(CNC1(COC2CCCCC2)CCCC1)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C20H30N4O2/c21-12-16-8-9-17(13-22)24(16)19(25)14-23-20(10-4-5-11-20)15-26-18-6-2-1-3-7-18/h16-18,23H,1-11,14-15H2/t16-,17+
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n/an/a 702n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187303
PNG
((2R,5S)-1-(2-(1,3-dimethylcyclopentylamino)acetyl)...)
Show SMILES CC1CCC(C)(C1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C15H22N4O/c1-11-5-6-15(2,7-11)18-10-14(20)19-12(8-16)3-4-13(19)9-17/h11-13,18H,3-7,10H2,1-2H3/t11?,12-,13+,15?
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n/an/a 771n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187289
PNG
((2R,5S)-1-(2-(2-(hydroxymethyl)-2,3-dihydro-1H-ind...)
Show SMILES OCC1(Cc2ccccc2C1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C18H20N4O2/c19-9-15-5-6-16(10-20)22(15)17(24)11-21-18(12-23)7-13-3-1-2-4-14(13)8-18/h1-4,15-16,21,23H,5-8,11-12H2/t15-,16+
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n/an/a 875n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187302
PNG
((2R,5S)-1-(2-(1-(2-methoxyethyl)cyclopentylamino)a...)
Show SMILES COCCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C16H24N4O2/c1-22-9-8-16(6-2-3-7-16)19-12-15(21)20-13(10-17)4-5-14(20)11-18/h13-14,19H,2-9,12H2,1H3/t13-,14+
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n/an/a 955n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187278
PNG
((2R,5S)-1-(2-(1-hydroxy-2-methylpropan-2-ylamino)a...)
Show SMILES CC(C)(CO)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C12H18N4O2/c1-12(2,8-17)15-7-11(18)16-9(5-13)3-4-10(16)6-14/h9-10,15,17H,3-4,7-8H2,1-2H3/t9-,10+
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n/an/a 1.11E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187301
PNG
((2R,5S)-1-(2-(1-benzylcyclobutylamino)acetyl)pyrro...)
Show SMILES O=C(CNC1(Cc2ccccc2)CCC1)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C19H22N4O/c20-12-16-7-8-17(13-21)23(16)18(24)14-22-19(9-4-10-19)11-15-5-2-1-3-6-15/h1-3,5-6,16-17,22H,4,7-11,14H2/t16-,17+
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n/an/a 1.16E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187293
PNG
((2R,5S)-1-(2-(4-(hydroxymethyl)-tetrahydro-2H-pyra...)
Show SMILES OCC1(CCOCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C14H20N4O3/c15-7-11-1-2-12(8-16)18(11)13(20)9-17-14(10-19)3-5-21-6-4-14/h11-12,17,19H,1-6,9-10H2/t11-,12+
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n/an/a 1.22E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187290
PNG
((2R,5S)-1-(2-(1-(3,3-dimethyl-2-oxobutyl)cyclopent...)
Show SMILES CC(C)(C)C(=O)CC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C19H28N4O2/c1-18(2,3)16(24)10-19(8-4-5-9-19)22-13-17(25)23-14(11-20)6-7-15(23)12-21/h14-15,22H,4-10,13H2,1-3H3/t14-,15+
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n/an/a 1.86E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187295
PNG
((2R,5S)-1-(2-(3-methylpentan-3-ylamino)acetyl)pyrr...)
Show SMILES CCC(C)(CC)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C14H22N4O/c1-4-14(3,5-2)17-10-13(19)18-11(8-15)6-7-12(18)9-16/h11-12,17H,4-7,10H2,1-3H3/t11-,12+
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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


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187272
PNG
((2R,5S)-1-(2-(2,3-dimethylbutan-2-ylamino)acetyl)p...)
Show SMILES CC(C)C(C)(C)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C14H22N4O/c1-10(2)14(3,4)17-9-13(19)18-11(7-15)5-6-12(18)8-16/h10-12,17H,5-6,9H2,1-4H3/t11-,12+
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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


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187292
PNG
((2R,5S)-1-(2-(2,2,5-trimethyl-1,3-dioxan-5-ylamino...)
Show SMILES CC1(C)OCC(C)(CO1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C15H22N4O3/c1-14(2)21-9-15(3,10-22-14)18-8-13(20)19-11(6-16)4-5-12(19)7-17/h11-12,18H,4-5,8-10H2,1-3H3/t11-,12+
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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


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187300
PNG
((2R,5S)-1-(2-(1-ethylcyclohexylamino)acetyl)pyrrol...)
Show SMILES CCC1(CCCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C16H24N4O/c1-2-16(8-4-3-5-9-16)19-12-15(21)20-13(10-17)6-7-14(20)11-18/h13-14,19H,2-9,12H2,1H3/t13-,14+
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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


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187259
PNG
((2R,5S)-1-(2-(1,2,2-trimethylcyclopentylamino)acet...)
Show SMILES CC1(C)CCCC1(C)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C16H24N4O/c1-15(2)7-4-8-16(15,3)19-11-14(21)20-12(9-17)5-6-13(20)10-18/h12-13,19H,4-8,11H2,1-3H3/t12-,13+,16?
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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


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187287
PNG
((2R,5S)-1-(2-(1-benzylcyclohexylamino)acetyl)pyrro...)
Show SMILES O=C(CNC1(Cc2ccccc2)CCCCC1)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C21H26N4O/c22-14-18-9-10-19(15-23)25(18)20(26)16-24-21(11-5-2-6-12-21)13-17-7-3-1-4-8-17/h1,3-4,7-8,18-19,24H,2,5-6,9-13,16H2/t18-,19+
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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


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187304
PNG
((2R,5S)-1-(2-((3S,4R)-1,3,4-trimethylcyclopentylam...)
Show SMILES C[C@H]1CC(C)(C[C@H]1C)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C16H24N4O/c1-11-6-16(3,7-12(11)2)19-10-15(21)20-13(8-17)4-5-14(20)9-18/h11-14,19H,4-7,10H2,1-3H3/t11-,12+,13-,14+,16?
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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


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187285
PNG
((2R,5S)-1-(2-(1-(3-hydroxypropyl)cyclohexylamino)a...)
Show SMILES OCCCC1(CCCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C17H26N4O2/c18-11-14-5-6-15(12-19)21(14)16(23)13-20-17(9-4-10-22)7-2-1-3-8-17/h14-15,20,22H,1-10,13H2/t14-,15+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187282
PNG
((2R,5S)-1-(2-(1-(2-hydroxyethyl)cyclopentylamino)a...)
Show SMILES OCCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C15H22N4O2/c16-9-12-3-4-13(10-17)19(12)14(21)11-18-15(7-8-20)5-1-2-6-15/h12-13,18,20H,1-8,11H2/t12-,13+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187288
PNG
(1-(2-((2R,5S)-2,5-dicyanopyrrolidin-1-yl)-2-oxoeth...)
Show SMILES CNC(=O)C1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C15H21N5O2/c1-18-14(22)15(6-2-3-7-15)19-10-13(21)20-11(8-16)4-5-12(20)9-17/h11-12,19H,2-7,10H2,1H3,(H,18,22)/t11-,12+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187291
PNG
((2R,5S)-1-(2-(tert-pentylamino)acetyl)pyrrolidine-...)
Show SMILES CCC(C)(C)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C13H20N4O/c1-4-13(2,3)16-9-12(18)17-10(7-14)5-6-11(17)8-15/h10-11,16H,4-6,9H2,1-3H3/t10-,11+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187264
PNG
((2R,5S)-1-(2-(2,3,3-trimethylbutan-2-ylamino)acety...)
Show SMILES CC(C)(C)C(C)(C)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C15H24N4O/c1-14(2,3)15(4,5)18-10-13(20)19-11(8-16)6-7-12(19)9-17/h11-12,18H,6-7,10H2,1-5H3/t11-,12+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187281
PNG
((2R,5S)-1-(2-(1-ethynylcyclohexylamino)acetyl)pyrr...)
Show SMILES O=C(CNC1(CCCCC1)C#C)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C16H20N4O/c1-2-16(8-4-3-5-9-16)19-12-15(21)20-13(10-17)6-7-14(20)11-18/h1,13-14,19H,3-9,12H2/t13-,14+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187296
PNG
((2R,5S)-1-(2-(1-methyl-3-tert-pentylcyclopentylami...)
Show SMILES CCC(C)(C)C1CCC(C)(C1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C19H30N4O/c1-5-18(2,3)14-8-9-19(4,10-14)22-13-17(24)23-15(11-20)6-7-16(23)12-21/h14-16,22H,5-10,13H2,1-4H3/t14?,15-,16+,19?
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187262
PNG
(CHEMBL209933 | methyl 1-(2-((2R,5S)-2,5-dicyanopyr...)
Show SMILES COC(=O)C1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C15H20N4O3/c1-22-14(21)15(6-2-3-7-15)18-10-13(20)19-11(8-16)4-5-12(19)9-17/h11-12,18H,2-7,10H2,1H3/t11-,12+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187277
PNG
((2S,5R)-1-[2-(3,5,7-trifluoro-adamantan-1-ylamino)...)
Show SMILES FC12CC3(F)CC(F)(C1)CC(C2)(C3)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C18H21F3N4O/c19-15-6-16(20)8-17(21,7-15)11-18(9-15,10-16)24-5-14(26)25-12(3-22)1-2-13(25)4-23/h12-13,24H,1-2,5-11H2/t12-,13+,15?,16?,17?,18?
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187286
PNG
((2R,5S)-1-(2-(3-methyl-tetrahydrothiophen-3-ylamin...)
Show SMILES CC1(CCSC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C13H18N4OS/c1-13(4-5-19-9-13)16-8-12(18)17-10(6-14)2-3-11(17)7-15/h10-11,16H,2-5,8-9H2,1H3/t10-,11+,13?
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Xaa-Pro aminopeptidase 1


(Homo sapiens (Human))
BDBM50187261
PNG
((2R,5S)-1-(2-(1-(butoxymethyl)cyclopentylamino)ace...)
Show SMILES CCCCOCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C18H28N4O2/c1-2-3-10-24-14-18(8-4-5-9-18)21-13-17(23)22-15(11-19)6-7-16(22)12-20/h15-16,21H,2-10,13-14H2,1H3/t15-,16+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of APP


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50187283
PNG
((2R,5S)-1-(2-(1-(ethoxymethyl)cyclopentylamino)ace...)
Show SMILES CCOCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C16H24N4O2/c1-2-22-12-16(7-3-4-8-16)19-11-15(21)20-13(9-17)5-6-14(20)10-18/h13-14,19H,2-8,11-12H2,1H3/t13-,14+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP8


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase IX


(Homo sapiens (Human))
BDBM50187268
PNG
((2S,5R)-1-[2-(adamantan-1-ylamino)-acetyl]-pyrroli...)
Show SMILES O=C(CNC12CC3CC(CC(C3)C1)C2)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C18H24N4O/c19-9-15-1-2-16(10-20)22(15)17(23)11-21-18-6-12-3-13(7-18)5-14(4-12)8-18/h12-16,21H,1-8,11H2/t12?,13?,14?,15-,16+,18?
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP9


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50187268
PNG
((2S,5R)-1-[2-(adamantan-1-ylamino)-acetyl]-pyrroli...)
Show SMILES O=C(CNC12CC3CC(CC(C3)C1)C2)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C18H24N4O/c19-9-15-1-2-16(10-20)22(15)17(23)11-21-18-6-12-3-13(7-18)5-14(4-12)8-18/h12-16,21H,1-8,11H2/t12?,13?,14?,15-,16+,18?
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP8


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Fibroblast activation protein alpha


(Homo sapiens (Human))
BDBM50187275
PNG
((2R,5S)-1-(2-(1-(methoxymethyl)cyclopentylamino)ac...)
Show SMILES COCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C15H22N4O2/c1-21-11-15(6-2-3-7-15)18-10-14(20)19-12(8-16)4-5-13(19)9-17/h12-13,18H,2-7,10-11H2,1H3/t12-,13+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of FAP


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50187258
PNG
((2S,5R)-1-[2-(hexahydro-2,5-methano-pentalen-3a-yl...)
Show SMILES O=C(CNC12CC3CC1CC(C2)C3)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C17H22N4O/c18-8-14-1-2-15(9-19)21(14)16(22)10-20-17-6-11-3-12(7-17)5-13(17)4-11/h11-15,20H,1-7,10H2/t11?,12?,13?,14-,15+,17?
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP8


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase III


(Homo sapiens (Human))
BDBM50187268
PNG
((2S,5R)-1-[2-(adamantan-1-ylamino)-acetyl]-pyrroli...)
Show SMILES O=C(CNC12CC3CC(CC(C3)C1)C2)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C18H24N4O/c19-9-15-1-2-16(10-20)22(15)17(23)11-21-18-6-12-3-13(7-18)5-14(4-12)8-18/h12-16,21H,1-8,11H2/t12?,13?,14?,15-,16+,18?
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP3


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase III


(Homo sapiens (Human))
BDBM50187261
PNG
((2R,5S)-1-(2-(1-(butoxymethyl)cyclopentylamino)ace...)
Show SMILES CCCCOCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C18H28N4O2/c1-2-3-10-24-14-18(8-4-5-9-18)21-13-17(23)22-15(11-19)6-7-16(22)12-20/h15-16,21H,2-10,13-14H2,1H3/t15-,16+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP3


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase IX


(Homo sapiens (Human))
BDBM50187261
PNG
((2R,5S)-1-(2-(1-(butoxymethyl)cyclopentylamino)ace...)
Show SMILES CCCCOCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C18H28N4O2/c1-2-3-10-24-14-18(8-4-5-9-18)21-13-17(23)22-15(11-19)6-7-16(22)12-20/h15-16,21H,2-10,13-14H2,1H3/t15-,16+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP9


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase IX


(Homo sapiens (Human))
BDBM50187263
PNG
((2S,5R)-1-[2-(3-hydroxy-adamantan-1-ylamino)-acety...)
Show SMILES OC12CC3CC(C1)CC(C3)(C2)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C18H24N4O2/c19-8-14-1-2-15(9-20)22(14)16(23)10-21-17-4-12-3-13(5-17)7-18(24,6-12)11-17/h12-15,21,24H,1-7,10-11H2/t12?,13?,14-,15+,17?,18?
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP9


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50187261
PNG
((2R,5S)-1-(2-(1-(butoxymethyl)cyclopentylamino)ace...)
Show SMILES CCCCOCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C18H28N4O2/c1-2-3-10-24-14-18(8-4-5-9-18)21-13-17(23)22-15(11-19)6-7-16(22)12-20/h15-16,21H,2-10,13-14H2,1H3/t15-,16+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP8


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Fibroblast activation protein alpha


(Homo sapiens (Human))
BDBM50187263
PNG
((2S,5R)-1-[2-(3-hydroxy-adamantan-1-ylamino)-acety...)
Show SMILES OC12CC3CC(C1)CC(C3)(C2)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C18H24N4O2/c19-8-14-1-2-15(9-20)22(14)16(23)10-21-17-4-12-3-13(5-17)7-18(24,6-12)11-17/h12-15,21,24H,1-7,10-11H2/t12?,13?,14-,15+,17?,18?
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of FAP


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Fibroblast activation protein alpha


(Homo sapiens (Human))
BDBM50187266
PNG
((2R,5S)-1-(2-(1-(hydroxymethyl)cyclopentylamino)ac...)
Show SMILES OCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C14H20N4O2/c15-7-11-3-4-12(8-16)18(11)13(20)9-17-14(10-19)5-1-2-6-14/h11-12,17,19H,1-6,9-10H2/t11-,12+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of FAP


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50187266
PNG
((2R,5S)-1-(2-(1-(hydroxymethyl)cyclopentylamino)ac...)
Show SMILES OCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C14H20N4O2/c15-7-11-3-4-12(8-16)18(11)13(20)9-17-14(10-19)5-1-2-6-14/h11-12,17,19H,1-6,9-10H2/t11-,12+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP2


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Xaa-Pro aminopeptidase 1


(Homo sapiens (Human))
BDBM50187258
PNG
((2S,5R)-1-[2-(hexahydro-2,5-methano-pentalen-3a-yl...)
Show SMILES O=C(CNC12CC3CC1CC(C2)C3)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C17H22N4O/c18-8-14-1-2-15(9-19)21(14)16(22)10-20-17-6-11-3-12(7-17)5-13(17)4-11/h11-15,20H,1-7,10H2/t11?,12?,13?,14-,15+,17?
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of APP


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50187283
PNG
((2R,5S)-1-(2-(1-(ethoxymethyl)cyclopentylamino)ace...)
Show SMILES CCOCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C16H24N4O2/c1-2-22-12-16(7-3-4-8-16)19-11-15(21)20-13(9-17)5-6-14(20)10-18/h13-14,19H,2-8,11-12H2,1H3/t13-,14+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP2


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase IX


(Homo sapiens (Human))
BDBM50187266
PNG
((2R,5S)-1-(2-(1-(hydroxymethyl)cyclopentylamino)ac...)
Show SMILES OCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C14H20N4O2/c15-7-11-3-4-12(8-16)18(11)13(20)9-17-14(10-19)5-1-2-6-14/h11-12,17,19H,1-6,9-10H2/t11-,12+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP9


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Xaa-Pro aminopeptidase 1


(Homo sapiens (Human))
BDBM50187263
PNG
((2S,5R)-1-[2-(3-hydroxy-adamantan-1-ylamino)-acety...)
Show SMILES OC12CC3CC(C1)CC(C3)(C2)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C18H24N4O2/c19-8-14-1-2-15(9-20)22(14)16(23)10-21-17-4-12-3-13(5-17)7-18(24,6-12)11-17/h12-15,21,24H,1-7,10-11H2/t12?,13?,14-,15+,17?,18?
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of APP


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase IX


(Homo sapiens (Human))
BDBM50187258
PNG
((2S,5R)-1-[2-(hexahydro-2,5-methano-pentalen-3a-yl...)
Show SMILES O=C(CNC12CC3CC1CC(C2)C3)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C17H22N4O/c18-8-14-1-2-15(9-19)21(14)16(22)10-20-17-6-11-3-12(7-17)5-13(17)4-11/h11-15,20H,1-7,10H2/t11?,12?,13?,14-,15+,17?
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP9


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50187275
PNG
((2R,5S)-1-(2-(1-(methoxymethyl)cyclopentylamino)ac...)
Show SMILES COCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C15H22N4O2/c1-21-11-15(6-2-3-7-15)18-10-14(20)19-12(8-16)4-5-13(19)9-17/h12-13,18H,2-7,10-11H2,1H3/t12-,13+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP8


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187297
PNG
((2S,5S)-1-[2-(adamantan-1-ylamino)-acetyl]-5-methy...)
Show SMILES C[C@H]1CC[C@@H](C#N)N1C(=O)CNC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C18H27N3O/c1-12-2-3-16(10-19)21(12)17(22)11-20-18-7-13-4-14(8-18)6-15(5-13)9-18/h12-16,20H,2-9,11H2,1H3/t12-,13?,14?,15?,16-,18?/m0/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50187261
PNG
((2R,5S)-1-(2-(1-(butoxymethyl)cyclopentylamino)ace...)
Show SMILES CCCCOCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C18H28N4O2/c1-2-3-10-24-14-18(8-4-5-9-18)21-13-17(23)22-15(11-19)6-7-16(22)12-20/h15-16,21H,2-10,13-14H2,1H3/t15-,16+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP2


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187270
PNG
((2R,5R)-1-[2-(adamantan-1-ylamino)-acetyl]-pyrroli...)
Show SMILES O=C(CNC12CC3CC(CC(C3)C1)C2)N1[C@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C18H24N4O/c19-9-15-1-2-16(10-20)22(15)17(23)11-21-18-6-12-3-13(7-18)5-14(4-12)8-18/h12-16,21H,1-8,11H2/t12?,13?,14?,15-,16-,18?/m1/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187284
PNG
((2S,5R)-1-(2-(1-(hydroxymethyl)cyclopentylamino)ac...)
Show SMILES OCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1c1ccccc1)C#N
Show InChI InChI=1S/C19H25N3O2/c20-12-16-8-9-17(15-6-2-1-3-7-15)22(16)18(24)13-21-19(14-23)10-4-5-11-19/h1-3,6-7,16-17,21,23H,4-5,8-11,13-14H2/t16-,17+/m0/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50187263
PNG
((2S,5R)-1-[2-(3-hydroxy-adamantan-1-ylamino)-acety...)
Show SMILES OC12CC3CC(C1)CC(C3)(C2)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C18H24N4O2/c19-8-14-1-2-15(9-20)22(14)16(23)10-21-17-4-12-3-13(5-17)7-18(24,6-12)11-17/h12-15,21,24H,1-7,10-11H2/t12?,13?,14-,15+,17?,18?
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP2


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase III


(Homo sapiens (Human))
BDBM50187266
PNG
((2R,5S)-1-(2-(1-(hydroxymethyl)cyclopentylamino)ac...)
Show SMILES OCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C14H20N4O2/c15-7-11-3-4-12(8-16)18(11)13(20)9-17-14(10-19)5-1-2-6-14/h11-12,17,19H,1-6,9-10H2/t11-,12+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP3


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187267
PNG
((2R,5R)-1-(2-(1-(hydroxymethyl)cyclopentylamino)ac...)
Show SMILES OCC1(CCCC1)NCC(=O)N1[C@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C14H20N4O2/c15-7-11-3-4-12(8-16)18(11)13(20)9-17-14(10-19)5-1-2-6-14/h11-12,17,19H,1-6,9-10H2/t11-,12-/m1/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Xaa-Pro aminopeptidase 1


(Homo sapiens (Human))
BDBM50187266
PNG
((2R,5S)-1-(2-(1-(hydroxymethyl)cyclopentylamino)ac...)
Show SMILES OCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C14H20N4O2/c15-7-11-3-4-12(8-16)18(11)13(20)9-17-14(10-19)5-1-2-6-14/h11-12,17,19H,1-6,9-10H2/t11-,12+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of APP


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase III


(Homo sapiens (Human))
BDBM50187275
PNG
((2R,5S)-1-(2-(1-(methoxymethyl)cyclopentylamino)ac...)
Show SMILES COCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C15H22N4O2/c1-21-11-15(6-2-3-7-15)18-10-14(20)19-12(8-16)4-5-13(19)9-17/h12-13,18H,2-7,10-11H2,1H3/t12-,13+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP3


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase IX


(Homo sapiens (Human))
BDBM50187275
PNG
((2R,5S)-1-(2-(1-(methoxymethyl)cyclopentylamino)ac...)
Show SMILES COCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C15H22N4O2/c1-21-11-15(6-2-3-7-15)18-10-14(20)19-12(8-16)4-5-13(19)9-17/h12-13,18H,2-7,10-11H2,1H3/t12-,13+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP9


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Xaa-Pro aminopeptidase 1


(Homo sapiens (Human))
BDBM50187268
PNG
((2S,5R)-1-[2-(adamantan-1-ylamino)-acetyl]-pyrroli...)
Show SMILES O=C(CNC12CC3CC(CC(C3)C1)C2)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C18H24N4O/c19-9-15-1-2-16(10-20)22(15)17(23)11-21-18-6-12-3-13(7-18)5-14(4-12)8-18/h12-16,21H,1-8,11H2/t12?,13?,14?,15-,16+,18?
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of APP


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase III


(Homo sapiens (Human))
BDBM50187258
PNG
((2S,5R)-1-[2-(hexahydro-2,5-methano-pentalen-3a-yl...)
Show SMILES O=C(CNC12CC3CC1CC(C2)C3)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C17H22N4O/c18-8-14-1-2-15(9-19)21(14)16(22)10-20-17-6-11-3-12(7-17)5-13(17)4-11/h11-15,20H,1-7,10H2/t11?,12?,13?,14-,15+,17?
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP3


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase IX


(Homo sapiens (Human))
BDBM50187283
PNG
((2R,5S)-1-(2-(1-(ethoxymethyl)cyclopentylamino)ace...)
Show SMILES CCOCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C16H24N4O2/c1-2-22-12-16(7-3-4-8-16)19-11-15(21)20-13(9-17)5-6-14(20)10-18/h13-14,19H,2-8,11-12H2,1H3/t13-,14+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP9


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Fibroblast activation protein alpha


(Homo sapiens (Human))
BDBM50187258
PNG
((2S,5R)-1-[2-(hexahydro-2,5-methano-pentalen-3a-yl...)
Show SMILES O=C(CNC12CC3CC1CC(C2)C3)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C17H22N4O/c18-8-14-1-2-15(9-19)21(14)16(22)10-20-17-6-11-3-12(7-17)5-13(17)4-11/h11-15,20H,1-7,10H2/t11?,12?,13?,14-,15+,17?
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of FAP


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50187258
PNG
((2S,5R)-1-[2-(hexahydro-2,5-methano-pentalen-3a-yl...)
Show SMILES O=C(CNC12CC3CC1CC(C2)C3)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C17H22N4O/c18-8-14-1-2-15(9-19)21(14)16(22)10-20-17-6-11-3-12(7-17)5-13(17)4-11/h11-15,20H,1-7,10H2/t11?,12?,13?,14-,15+,17?
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP2


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50187268
PNG
((2S,5R)-1-[2-(adamantan-1-ylamino)-acetyl]-pyrroli...)
Show SMILES O=C(CNC12CC3CC(CC(C3)C1)C2)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C18H24N4O/c19-9-15-1-2-16(10-20)22(15)17(23)11-21-18-6-12-3-13(7-18)5-14(4-12)8-18/h12-16,21H,1-8,11H2/t12?,13?,14?,15-,16+,18?
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP2


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Xaa-Pro aminopeptidase 1


(Homo sapiens (Human))
BDBM50187283
PNG
((2R,5S)-1-(2-(1-(ethoxymethyl)cyclopentylamino)ace...)
Show SMILES CCOCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C16H24N4O2/c1-2-22-12-16(7-3-4-8-16)19-11-15(21)20-13(9-17)5-6-14(20)10-18/h13-14,19H,2-8,11-12H2,1H3/t13-,14+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of APP


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Xaa-Pro aminopeptidase 1


(Homo sapiens (Human))
BDBM50187275
PNG
((2R,5S)-1-(2-(1-(methoxymethyl)cyclopentylamino)ac...)
Show SMILES COCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C15H22N4O2/c1-21-11-15(6-2-3-7-15)18-10-14(20)19-12(8-16)4-5-13(19)9-17/h12-13,18H,2-7,10-11H2,1H3/t12-,13+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of APP


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50187266
PNG
((2R,5S)-1-(2-(1-(hydroxymethyl)cyclopentylamino)ac...)
Show SMILES OCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C14H20N4O2/c15-7-11-3-4-12(8-16)18(11)13(20)9-17-14(10-19)5-1-2-6-14/h11-12,17,19H,1-6,9-10H2/t11-,12+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP8


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50187275
PNG
((2R,5S)-1-(2-(1-(methoxymethyl)cyclopentylamino)ac...)
Show SMILES COCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C15H22N4O2/c1-21-11-15(6-2-3-7-15)18-10-14(20)19-12(8-16)4-5-13(19)9-17/h12-13,18H,2-7,10-11H2,1H3/t12-,13+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP2


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Fibroblast activation protein alpha


(Homo sapiens (Human))
BDBM50187268
PNG
((2S,5R)-1-[2-(adamantan-1-ylamino)-acetyl]-pyrroli...)
Show SMILES O=C(CNC12CC3CC(CC(C3)C1)C2)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C18H24N4O/c19-9-15-1-2-16(10-20)22(15)17(23)11-21-18-6-12-3-13(7-18)5-14(4-12)8-18/h12-16,21H,1-8,11H2/t12?,13?,14?,15-,16+,18?
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of FAP


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Fibroblast activation protein alpha


(Homo sapiens (Human))
BDBM50187261
PNG
((2R,5S)-1-(2-(1-(butoxymethyl)cyclopentylamino)ace...)
Show SMILES CCCCOCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C18H28N4O2/c1-2-3-10-24-14-18(8-4-5-9-18)21-13-17(23)22-15(11-19)6-7-16(22)12-20/h15-16,21H,2-10,13-14H2,1H3/t15-,16+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of FAP


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Fibroblast activation protein alpha


(Homo sapiens (Human))
BDBM50187283
PNG
((2R,5S)-1-(2-(1-(ethoxymethyl)cyclopentylamino)ace...)
Show SMILES CCOCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C16H24N4O2/c1-2-22-12-16(7-3-4-8-16)19-11-15(21)20-13(9-17)5-6-14(20)10-18/h13-14,19H,2-8,11-12H2,1H3/t13-,14+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of FAP


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50187263
PNG
((2S,5R)-1-[2-(3-hydroxy-adamantan-1-ylamino)-acety...)
Show SMILES OC12CC3CC(C1)CC(C3)(C2)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C18H24N4O2/c19-8-14-1-2-15(9-20)22(14)16(23)10-21-17-4-12-3-13(5-17)7-18(24,6-12)11-17/h12-15,21,24H,1-7,10-11H2/t12?,13?,14-,15+,17?,18?
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP8


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50187299
PNG
((2S,4S)-1-[2-(Adamantan-1-ylamino)-acetyl]-4-hydro...)
Show SMILES O[C@H]1C[C@@H](C#N)N(C1)C(=O)CNC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C17H25N3O2/c18-8-14-4-15(21)10-20(14)16(22)9-19-17-5-11-1-12(6-17)3-13(2-11)7-17/h11-15,19,21H,1-7,9-10H2/t11?,12?,13?,14-,15-,17?/m0/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase III


(Homo sapiens (Human))
BDBM50187283
PNG
((2R,5S)-1-(2-(1-(ethoxymethyl)cyclopentylamino)ace...)
Show SMILES CCOCC1(CCCC1)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C16H24N4O2/c1-2-22-12-16(7-3-4-8-16)19-11-15(21)20-13(9-17)5-6-14(20)10-18/h13-14,19H,2-8,11-12H2,1H3/t13-,14+
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP3


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
Dipeptidyl peptidase III


(Homo sapiens (Human))
BDBM50187263
PNG
((2S,5R)-1-[2-(3-hydroxy-adamantan-1-ylamino)-acety...)
Show SMILES OC12CC3CC(C1)CC(C3)(C2)NCC(=O)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C18H24N4O2/c19-8-14-1-2-15(9-20)22(14)16(23)10-21-17-4-12-3-13(5-17)7-18(24,6-12)11-17/h12-15,21,24H,1-7,10-11H2/t12?,13?,14-,15+,17?,18?
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of DPP3


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%