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Compile Data Set for Download or QSAR

Found 49 hits of Enz. Inhib. data with enzyme = 'Dipeptidyl peptidase 4' and Substrate = 'BDBM11114'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11123
PNG
((2S)-1-[(2S)-2-amino-3-[4-(2,4-difluorophenyl)phen...)
Show SMILES N[C@@H](Cc1ccc(cc1)-c1ccc(F)cc1F)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C20H19F2N3O/c21-15-7-8-17(18(22)11-15)14-5-3-13(4-6-14)10-19(24)20(26)25-9-1-2-16(25)12-23/h3-8,11,16,19H,1-2,9-10,24H2/t16-,19-/m0/s1
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PubMed
2.20 -11.8n/an/an/an/an/a7.425



Johnson & Johnson Pharmaceutical



Assay Description
The progress of DPPIV inhibition by compounds was measured by recording the liberation of free pNA at 405 nm. IC50 was determined from the slope of r...


Bioorg Med Chem Lett 16: 123-8 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.037
BindingDB Entry DOI: 10.7270/Q2S180QJ
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11911
PNG
((2S)-2-amino-N-(cyanomethyl)-N-ethyl-2-(3-hydroxya...)
Show SMILES CCN(CC#N)C(=O)[C@@H](N)[C@@]12CC3CC(CC(O)(C3)C1)C2
Show InChI InChI=1S/C16H25N3O2/c1-2-19(4-3-17)14(20)13(18)15-6-11-5-12(7-15)9-16(21,8-11)10-15/h11-13,21H,2,4-10,18H2,1H3/t11?,12?,13-,15-,16?/m1/s1
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PubMed
3 -11.5n/an/an/an/an/a7.422



Bristol-Myers Squibb Pharmaceutical Research Institute



Assay Description
Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...


Bioorg Med Chem Lett 16: 1731-4 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.098
BindingDB Entry DOI: 10.7270/Q2HD7SXP
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11121
PNG
((2S)-1-[(2S)-2-amino-3-[4-(4-fluorophenyl)phenyl]p...)
Show SMILES N[C@@H](Cc1ccc(cc1)-c1ccc(F)cc1)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C20H20FN3O/c21-17-9-7-16(8-10-17)15-5-3-14(4-6-15)12-19(23)20(25)24-11-1-2-18(24)13-22/h3-10,18-19H,1-2,11-12,23H2/t18-,19-/m0/s1
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PubMed
3.10 -11.6n/an/an/an/an/a7.425



Johnson & Johnson Pharmaceutical



Assay Description
The progress of DPPIV inhibition by compounds was measured by recording the liberation of free pNA at 405 nm. IC50 was determined from the slope of r...


Bioorg Med Chem Lett 16: 123-8 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.037
BindingDB Entry DOI: 10.7270/Q2S180QJ
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11122
PNG
((2S)-1-[(2S)-2-amino-3-[4-(2-fluorophenyl)phenyl]p...)
Show SMILES N[C@@H](Cc1ccc(cc1)-c1ccccc1F)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C20H20FN3O/c21-18-6-2-1-5-17(18)15-9-7-14(8-10-15)12-19(23)20(25)24-11-3-4-16(24)13-22/h1-2,5-10,16,19H,3-4,11-12,23H2/t16-,19-/m0/s1
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PubMed
5.30 -11.3n/an/an/an/an/a7.425



Johnson & Johnson Pharmaceutical



Assay Description
The progress of DPPIV inhibition by compounds was measured by recording the liberation of free pNA at 405 nm. IC50 was determined from the slope of r...


Bioorg Med Chem Lett 16: 123-8 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.037
BindingDB Entry DOI: 10.7270/Q2S180QJ
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11118
PNG
((2S)-1-[(2S)-2-amino-3-(4-phenylphenyl)propanoyl]p...)
Show SMILES N[C@@H](Cc1ccc(cc1)-c1ccccc1)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C20H21N3O/c21-14-18-7-4-12-23(18)20(24)19(22)13-15-8-10-17(11-9-15)16-5-2-1-3-6-16/h1-3,5-6,8-11,18-19H,4,7,12-13,22H2/t18-,19-/m0/s1
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13 -10.8n/an/an/an/an/a7.425



Johnson & Johnson Pharmaceutical



Assay Description
The progress of DPPIV inhibition by compounds was measured by recording the liberation of free pNA at 405 nm. IC50 was determined from the slope of r...


Bioorg Med Chem Lett 16: 123-8 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.037
BindingDB Entry DOI: 10.7270/Q2S180QJ
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11910
PNG
((2S)-2-amino-N-(cyanomethyl)-2-(3-hydroxyadamantan...)
Show SMILES CN(CC#N)C(=O)[C@@H](N)[C@@]12CC3CC(CC(O)(C3)C1)C2
Show InChI InChI=1S/C15H23N3O2/c1-18(3-2-16)13(19)12(17)14-5-10-4-11(6-14)8-15(20,7-10)9-14/h10-12,20H,3-9,17H2,1H3/t10?,11?,12-,14-,15?/m1/s1
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18 -10.5n/an/an/an/an/a7.422



Bristol-Myers Squibb Pharmaceutical Research Institute



Assay Description
Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...


Bioorg Med Chem Lett 16: 1731-4 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.098
BindingDB Entry DOI: 10.7270/Q2HD7SXP
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11119
PNG
((2S)-1-[(2S)-2-amino-3-[4-(4-methylphenyl)phenyl]p...)
Show SMILES Cc1ccc(cc1)-c1ccc(C[C@H](N)C(=O)N2CCC[C@H]2C#N)cc1
Show InChI InChI=1S/C21H23N3O/c1-15-4-8-17(9-5-15)18-10-6-16(7-11-18)13-20(23)21(25)24-12-2-3-19(24)14-22/h4-11,19-20H,2-3,12-13,23H2,1H3/t19-,20-/m0/s1
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20 -10.5n/an/an/an/an/a7.425



Johnson & Johnson Pharmaceutical



Assay Description
The progress of DPPIV inhibition by compounds was measured by recording the liberation of free pNA at 405 nm. IC50 was determined from the slope of r...


Bioorg Med Chem Lett 16: 123-8 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.037
BindingDB Entry DOI: 10.7270/Q2S180QJ
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11912
PNG
((2S)-2-amino-N-(cyanomethyl)-2-(3,5-dihydroxyadama...)
Show SMILES CN(CC#N)C(=O)[C@@H](N)[C@@]12CC3CC(O)(CC(O)(C3)C1)C2
Show InChI InChI=1S/C15H23N3O3/c1-18(3-2-16)12(19)11(17)13-4-10-5-14(20,7-13)9-15(21,6-10)8-13/h10-11,20-21H,3-9,17H2,1H3/t10?,11-,13-,14?,15?/m1/s1
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23 -10.3n/an/an/an/an/a7.422



Bristol-Myers Squibb Pharmaceutical Research Institute



Assay Description
Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...


Bioorg Med Chem Lett 16: 1731-4 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.098
BindingDB Entry DOI: 10.7270/Q2HD7SXP
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11120
PNG
((2S)-1-[(2S)-2-amino-3-[4-(3,4-dimethoxyphenyl)phe...)
Show SMILES COc1ccc(cc1OC)-c1ccc(C[C@H](N)C(=O)N2CCC[C@H]2C#N)cc1
Show InChI InChI=1S/C22H25N3O3/c1-27-20-10-9-17(13-21(20)28-2)16-7-5-15(6-8-16)12-19(24)22(26)25-11-3-4-18(25)14-23/h5-10,13,18-19H,3-4,11-12,24H2,1-2H3/t18-,19-/m0/s1
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26 -10.3n/an/an/an/an/a7.425



Johnson & Johnson Pharmaceutical



Assay Description
The progress of DPPIV inhibition by compounds was measured by recording the liberation of free pNA at 405 nm. IC50 was determined from the slope of r...


Bioorg Med Chem Lett 16: 123-8 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.037
BindingDB Entry DOI: 10.7270/Q2S180QJ
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11113
PNG
(6-{[2-({2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl...)
Show SMILES O=C(CNCCNc1ccc(cn1)C#N)N1CCC[C@H]1C#N
Show InChI InChI=1S/C15H18N6O/c16-8-12-3-4-14(20-10-12)19-6-5-18-11-15(22)21-7-1-2-13(21)9-17/h3-4,10,13,18H,1-2,5-7,11H2,(H,19,20)/t13-/m0/s1
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PubMed
27 -10.3n/an/an/an/an/a7.425



Johnson & Johnson Pharmaceutical



Assay Description
The progress of DPPIV inhibition by compounds was measured by recording the liberation of free pNA at 405 nm. IC50 was determined from the slope of r...


Bioorg Med Chem Lett 16: 123-8 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.037
BindingDB Entry DOI: 10.7270/Q2S180QJ
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11905
PNG
((2S)-2-(adamantan-1-yl)-2-amino-N-(cyanomethyl)-N-...)
Show SMILES CCN(CC#N)C(=O)[C@@H](N)[C@@]12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C16H25N3O/c1-2-19(4-3-17)15(20)14(18)16-8-11-5-12(9-16)7-13(6-11)10-16/h11-14H,2,4-10,18H2,1H3/t11?,12?,13?,14-,16-/m1/s1
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PubMed
27 -10.2n/an/an/an/an/a7.422



Bristol-Myers Squibb Pharmaceutical Research Institute



Assay Description
Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...


Bioorg Med Chem Lett 16: 1731-4 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.098
BindingDB Entry DOI: 10.7270/Q2HD7SXP
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11116
PNG
((2S)-1-[(2S)-2-amino-3-(4-iodophenyl)propanoyl]pyr...)
Show SMILES N[C@@H](Cc1ccc(I)cc1)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C14H16IN3O/c15-11-5-3-10(4-6-11)8-13(17)14(19)18-7-1-2-12(18)9-16/h3-6,12-13H,1-2,7-8,17H2/t12-,13-/m0/s1
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34 -10.2n/an/an/an/an/a7.425



Johnson & Johnson Pharmaceutical



Assay Description
The progress of DPPIV inhibition by compounds was measured by recording the liberation of free pNA at 405 nm. IC50 was determined from the slope of r...


Bioorg Med Chem Lett 16: 123-8 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.037
BindingDB Entry DOI: 10.7270/Q2S180QJ
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11124
PNG
((2S)-1-[(2S)-2-amino-3-[4-(furan-2-yl)phenyl]propa...)
Show SMILES N[C@@H](Cc1ccc(cc1)-c1ccco1)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C18H19N3O2/c19-12-15-3-1-9-21(15)18(22)16(20)11-13-5-7-14(8-6-13)17-4-2-10-23-17/h2,4-8,10,15-16H,1,3,9,11,20H2/t15-,16-/m0/s1
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36 -10.1n/an/an/an/an/a7.425



Johnson & Johnson Pharmaceutical



Assay Description
The progress of DPPIV inhibition by compounds was measured by recording the liberation of free pNA at 405 nm. IC50 was determined from the slope of r...


Bioorg Med Chem Lett 16: 123-8 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.037
BindingDB Entry DOI: 10.7270/Q2S180QJ
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11907
PNG
((2S)-2-(adamantan-1-yl)-2-amino-N-(cyanomethyl)-N-...)
Show SMILES N[C@H](C(=O)N(CC=C)CC#N)[C@@]12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C17H25N3O/c1-2-4-20(5-3-18)16(21)15(19)17-9-12-6-13(10-17)8-14(7-12)11-17/h2,12-15H,1,4-11,19H2/t12?,13?,14?,15-,17-/m1/s1
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37 -10.0n/an/an/an/an/a7.422



Bristol-Myers Squibb Pharmaceutical Research Institute



Assay Description
Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...


Bioorg Med Chem Lett 16: 1731-4 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.098
BindingDB Entry DOI: 10.7270/Q2HD7SXP
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11115
PNG
((2S)-1-[(2S)-2-amino-3-phenylpropanoyl]pyrrolidine...)
Show SMILES N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C14H17N3O/c15-10-12-7-4-8-17(12)14(18)13(16)9-11-5-2-1-3-6-11/h1-3,5-6,12-13H,4,7-9,16H2/t12-,13-/m0/s1
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63 -9.82n/an/an/an/an/a7.425



Johnson & Johnson Pharmaceutical



Assay Description
The progress of DPPIV inhibition by compounds was measured by recording the liberation of free pNA at 405 nm. IC50 was determined from the slope of r...


Bioorg Med Chem Lett 16: 123-8 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.037
BindingDB Entry DOI: 10.7270/Q2S180QJ
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11904
PNG
((2S)-2-(adamantan-1-yl)-2-amino-N-(cyanomethyl)-N-...)
Show SMILES CN(CC#N)C(=O)[C@@H](N)[C@@]12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C15H23N3O/c1-18(3-2-16)14(19)13(17)15-7-10-4-11(8-15)6-12(5-10)9-15/h10-13H,3-9,17H2,1H3/t10?,11?,12?,13-,15-/m1/s1
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PubMed
74 -9.62n/an/an/an/an/a7.422



Bristol-Myers Squibb Pharmaceutical Research Institute



Assay Description
Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...


Bioorg Med Chem Lett 16: 1731-4 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.098
BindingDB Entry DOI: 10.7270/Q2HD7SXP
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11136
PNG
((2S)-2-amino-3-[4-(2,4-difluorophenyl)phenyl]-1-(1...)
Show SMILES N[C@@H](Cc1ccc(cc1)-c1ccc(F)cc1F)C(=O)N1CCSC1
Show InChI InChI=1S/C18H18F2N2OS/c19-14-5-6-15(16(20)10-14)13-3-1-12(2-4-13)9-17(21)18(23)22-7-8-24-11-22/h1-6,10,17H,7-9,11,21H2/t17-/m0/s1
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PubMed
96 -9.57n/an/an/an/an/a7.425



Johnson & Johnson Pharmaceutical



Assay Description
The progress of DPPIV inhibition by compounds was measured by recording the liberation of free pNA at 405 nm. IC50 was determined from the slope of r...


Bioorg Med Chem Lett 16: 123-8 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.037
BindingDB Entry DOI: 10.7270/Q2S180QJ
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11896
PNG
((2S)-2-amino-N-(cyanomethyl)-N-cyclobutyl-3,3-dime...)
Show SMILES CC(C)(C)[C@H](N)C(=O)N(CC#N)C1CCC1
Show InChI InChI=1S/C12H21N3O/c1-12(2,3)10(14)11(16)15(8-7-13)9-5-4-6-9/h9-10H,4-6,8,14H2,1-3H3/t10-/m1/s1
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PubMed
140 -9.25n/an/an/an/an/a7.422



Bristol-Myers Squibb Pharmaceutical Research Institute



Assay Description
Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...


Bioorg Med Chem Lett 16: 1731-4 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.098
BindingDB Entry DOI: 10.7270/Q2HD7SXP
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11134
PNG
(4-{4-[(2S)-2-amino-3-oxo-3-(1,3-thiazolidin-3-yl)p...)
Show SMILES N[C@@H](Cc1ccc(cc1)-c1ccc(cc1)C#N)C(=O)N1CCSC1
Show InChI InChI=1S/C19H19N3OS/c20-12-15-3-7-17(8-4-15)16-5-1-14(2-6-16)11-18(21)19(23)22-9-10-24-13-22/h1-8,18H,9-11,13,21H2/t18-/m0/s1
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160 -9.26n/an/an/an/an/a7.425



Johnson & Johnson Pharmaceutical



Assay Description
The progress of DPPIV inhibition by compounds was measured by recording the liberation of free pNA at 405 nm. IC50 was determined from the slope of r...


Bioorg Med Chem Lett 16: 123-8 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.037
BindingDB Entry DOI: 10.7270/Q2S180QJ
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11133
PNG
(3-{4-[(2S)-2-amino-3-oxo-3-(1,3-thiazolidin-3-yl)p...)
Show SMILES N[C@@H](Cc1ccc(cc1)-c1cccc(c1)C(O)=O)C(=O)N1CCSC1
Show InChI InChI=1S/C19H20N2O3S/c20-17(18(22)21-8-9-25-12-21)10-13-4-6-14(7-5-13)15-2-1-3-16(11-15)19(23)24/h1-7,11,17H,8-10,12,20H2,(H,23,24)/t17-/m0/s1
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PubMed
166 -9.24n/an/an/an/an/a7.425



Johnson & Johnson Pharmaceutical



Assay Description
The progress of DPPIV inhibition by compounds was measured by recording the liberation of free pNA at 405 nm. IC50 was determined from the slope of r...


Bioorg Med Chem Lett 16: 123-8 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.037
BindingDB Entry DOI: 10.7270/Q2S180QJ
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11135
PNG
((2S)-2-amino-3-[4-(4-fluorophenyl)phenyl]-1-(1,3-t...)
Show SMILES N[C@@H](Cc1ccc(cc1)-c1ccc(F)cc1)C(=O)N1CCSC1
Show InChI InChI=1S/C18H19FN2OS/c19-16-7-5-15(6-8-16)14-3-1-13(2-4-14)11-17(20)18(22)21-9-10-23-12-21/h1-8,17H,9-12,20H2/t17-/m0/s1
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170 -9.23n/an/an/an/an/a7.425



Johnson & Johnson Pharmaceutical



Assay Description
The progress of DPPIV inhibition by compounds was measured by recording the liberation of free pNA at 405 nm. IC50 was determined from the slope of r...


Bioorg Med Chem Lett 16: 123-8 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.037
BindingDB Entry DOI: 10.7270/Q2S180QJ
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11892
PNG
((2S)-2-amino-N-(cyanomethyl)-N-ethyl-3,3-dimethylb...)
Show SMILES CCN(CC#N)C(=O)[C@@H](N)C(C)(C)C
Show InChI InChI=1S/C10H19N3O/c1-5-13(7-6-11)9(14)8(12)10(2,3)4/h8H,5,7,12H2,1-4H3/t8-/m1/s1
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PubMed
182 -9.10n/an/an/an/an/a7.422



Bristol-Myers Squibb Pharmaceutical Research Institute



Assay Description
Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...


Bioorg Med Chem Lett 16: 1731-4 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.098
BindingDB Entry DOI: 10.7270/Q2HD7SXP
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11908
PNG
((2S)-2-(adamantan-1-yl)-2-amino-N-(cyanomethyl)-N-...)
Show SMILES N[C@H](C(=O)N(CC#N)C1CC1)[C@@]12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C17H25N3O/c18-3-4-20(14-1-2-14)16(21)15(19)17-8-11-5-12(9-17)7-13(6-11)10-17/h11-15H,1-2,4-10,19H2/t11?,12?,13?,15-,17-/m1/s1
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188 -9.08n/an/an/an/an/a7.422



Bristol-Myers Squibb Pharmaceutical Research Institute



Assay Description
Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...


Bioorg Med Chem Lett 16: 1731-4 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.098
BindingDB Entry DOI: 10.7270/Q2HD7SXP
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11894
PNG
((2S)-2-amino-N-(cyanomethyl)-3,3-dimethyl-N-(prop-...)
Show SMILES CC(C)(C)[C@H](N)C(=O)N(CC=C)CC#N
Show InChI InChI=1S/C11H19N3O/c1-5-7-14(8-6-12)10(15)9(13)11(2,3)4/h5,9H,1,7-8,13H2,2-4H3/t9-/m1/s1
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PubMed
212 -9.01n/an/an/an/an/a7.422



Bristol-Myers Squibb Pharmaceutical Research Institute



Assay Description
Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...


Bioorg Med Chem Lett 16: 1731-4 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.098
BindingDB Entry DOI: 10.7270/Q2HD7SXP
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11890
PNG
((2S)-2-amino-N-(cyanomethyl)-N,3-dimethylbutanamid...)
Show SMILES CC(C)[C@H](N)C(=O)N(C)CC#N
Show InChI InChI=1S/C8H15N3O/c1-6(2)7(10)8(12)11(3)5-4-9/h6-7H,5,10H2,1-3H3/t7-/m0/s1
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260 -8.89n/an/an/an/an/a7.422



Bristol-Myers Squibb Pharmaceutical Research Institute



Assay Description
Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...


Bioorg Med Chem Lett 16: 1731-4 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.098
BindingDB Entry DOI: 10.7270/Q2HD7SXP
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11132
PNG
(4-{4-[(2S)-2-amino-3-oxo-3-(1,3-thiazolidin-3-yl)p...)
Show SMILES N[C@@H](Cc1ccc(cc1)-c1ccc(cc1)C(O)=O)C(=O)N1CCSC1
Show InChI InChI=1S/C19H20N2O3S/c20-17(18(22)21-9-10-25-12-21)11-13-1-3-14(4-2-13)15-5-7-16(8-6-15)19(23)24/h1-8,17H,9-12,20H2,(H,23,24)/t17-/m0/s1
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310 -8.87n/an/an/an/an/a7.425



Johnson & Johnson Pharmaceutical



Assay Description
The progress of DPPIV inhibition by compounds was measured by recording the liberation of free pNA at 405 nm. IC50 was determined from the slope of r...


Bioorg Med Chem Lett 16: 123-8 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.037
BindingDB Entry DOI: 10.7270/Q2S180QJ
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11131
PNG
((2S)-2-amino-3-[4-(pyridin-2-yl)phenyl]-1-(1,3-thi...)
Show SMILES N[C@@H](Cc1ccc(cc1)-c1ccccn1)C(=O)N1CCSC1
Show InChI InChI=1S/C17H19N3OS/c18-15(17(21)20-9-10-22-12-20)11-13-4-6-14(7-5-13)16-3-1-2-8-19-16/h1-8,15H,9-12,18H2/t15-/m0/s1
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355 -8.79n/an/an/an/an/a7.425



Johnson & Johnson Pharmaceutical



Assay Description
The progress of DPPIV inhibition by compounds was measured by recording the liberation of free pNA at 405 nm. IC50 was determined from the slope of r...


Bioorg Med Chem Lett 16: 123-8 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.037
BindingDB Entry DOI: 10.7270/Q2S180QJ
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11125
PNG
((2S)-2-amino-3-(4-phenylphenyl)-1-(1,3-thiazolidin...)
Show SMILES N[C@@H](Cc1ccc(cc1)-c1ccccc1)C(=O)N1CCSC1
Show InChI InChI=1S/C18H20N2OS/c19-17(18(21)20-10-11-22-13-20)12-14-6-8-16(9-7-14)15-4-2-1-3-5-15/h1-9,17H,10-13,19H2/t17-/m0/s1
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360 -8.78n/an/an/an/an/a7.425



Johnson & Johnson Pharmaceutical



Assay Description
The progress of DPPIV inhibition by compounds was measured by recording the liberation of free pNA at 405 nm. IC50 was determined from the slope of r...


Bioorg Med Chem Lett 16: 123-8 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.037
BindingDB Entry DOI: 10.7270/Q2S180QJ
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11901
PNG
((2S)-2-(adamantan-1-yl)-2-amino-N-[(1S)-1-cyanoeth...)
Show SMILES C[C@H](NC(=O)[C@@H](N)C12CC3CC(CC(C3)C1)C2)C#N
Show InChI InChI=1S/C15H23N3O/c1-9(8-16)18-14(19)13(17)15-5-10-2-11(6-15)4-12(3-10)7-15/h9-13H,2-7,17H2,1H3,(H,18,19)/t9-,10?,11?,12?,13+,15?/m0/s1
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399 -8.64n/an/an/an/an/a7.422



Bristol-Myers Squibb Pharmaceutical Research Institute



Assay Description
Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...


Bioorg Med Chem Lett 16: 1731-4 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.098
BindingDB Entry DOI: 10.7270/Q2HD7SXP
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11117
PNG
(4-[(2S)-2-amino-3-[(2S)-2-cyanopyrrolidin-1-yl]-3-...)
Show SMILES N[C@@H](Cc1ccc(cc1)C(O)=O)C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C15H17N3O3/c16-9-12-2-1-7-18(12)14(19)13(17)8-10-3-5-11(6-4-10)15(20)21/h3-6,12-13H,1-2,7-8,17H2,(H,20,21)/t12-,13-/m0/s1
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470 -8.63n/an/an/an/an/a7.425



Johnson & Johnson Pharmaceutical



Assay Description
The progress of DPPIV inhibition by compounds was measured by recording the liberation of free pNA at 405 nm. IC50 was determined from the slope of r...


Bioorg Med Chem Lett 16: 123-8 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.037
BindingDB Entry DOI: 10.7270/Q2S180QJ
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11891
PNG
((2S)-2-amino-N-(cyanomethyl)-N,3,3-trimethylbutana...)
Show SMILES CN(CC#N)C(=O)[C@@H](N)C(C)(C)C
Show InChI InChI=1S/C9H17N3O/c1-9(2,3)7(11)8(13)12(4)6-5-10/h7H,6,11H2,1-4H3/t7-/m1/s1
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PubMed
507 -8.50n/an/an/an/an/a7.422



Bristol-Myers Squibb Pharmaceutical Research Institute



Assay Description
Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...


Bioorg Med Chem Lett 16: 1731-4 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.098
BindingDB Entry DOI: 10.7270/Q2HD7SXP
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11897
PNG
((2S)-2-amino-N-[(1S)-1-cyanoethyl]-N,3,3-trimethyl...)
Show SMILES C[C@@H](C#N)N(C)C(=O)[C@@H](N)C(C)(C)C
Show InChI InChI=1S/C10H19N3O/c1-7(6-11)13(5)9(14)8(12)10(2,3)4/h7-8H,12H2,1-5H3/t7-,8+/m0/s1
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PubMed
513 -8.49n/an/an/an/an/a7.422



Bristol-Myers Squibb Pharmaceutical Research Institute



Assay Description
Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...


Bioorg Med Chem Lett 16: 1731-4 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.098
BindingDB Entry DOI: 10.7270/Q2HD7SXP
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11906
PNG
((2S)-2-(adamantan-1-yl)-2-amino-N-(cyanomethyl)-N-...)
Show SMILES CCCN(CC#N)C(=O)[C@@H](N)[C@@]12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C17H27N3O/c1-2-4-20(5-3-18)16(21)15(19)17-9-12-6-13(10-17)8-14(7-12)11-17/h12-15H,2,4-11,19H2,1H3/t12?,13?,14?,15-,17-/m1/s1
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PubMed
673 -8.33n/an/an/an/an/a7.422



Bristol-Myers Squibb Pharmaceutical Research Institute



Assay Description
Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...


Bioorg Med Chem Lett 16: 1731-4 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.098
BindingDB Entry DOI: 10.7270/Q2HD7SXP
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11130
PNG
((2S)-2-amino-3-(4-iodophenyl)-1-(1,3-thiazolidin-3...)
Show SMILES N[C@@H](Cc1ccc(I)cc1)C(=O)N1CCSC1
Show InChI InChI=1S/C12H15IN2OS/c13-10-3-1-9(2-4-10)7-11(14)12(16)15-5-6-17-8-15/h1-4,11H,5-8,14H2/t11-/m0/s1
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PubMed
980 -8.19n/an/an/an/an/a7.425



Johnson & Johnson Pharmaceutical



Assay Description
The progress of DPPIV inhibition by compounds was measured by recording the liberation of free pNA at 405 nm. IC50 was determined from the slope of r...


Bioorg Med Chem Lett 16: 123-8 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.037
BindingDB Entry DOI: 10.7270/Q2S180QJ
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11126
PNG
((2S)-2-amino-3-(4-phenylphenyl)-1-(pyrrolidin-1-yl...)
Show SMILES N[C@@H](Cc1ccc(cc1)-c1ccccc1)C(=O)N1CCCC1
Show InChI InChI=1S/C19H22N2O/c20-18(19(22)21-12-4-5-13-21)14-15-8-10-17(11-9-15)16-6-2-1-3-7-16/h1-3,6-11,18H,4-5,12-14,20H2/t18-/m0/s1
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PubMed
1.16E+3 -8.09n/an/an/an/an/a7.425



Johnson & Johnson Pharmaceutical



Assay Description
The progress of DPPIV inhibition by compounds was measured by recording the liberation of free pNA at 405 nm. IC50 was determined from the slope of r...


Bioorg Med Chem Lett 16: 123-8 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.037
BindingDB Entry DOI: 10.7270/Q2S180QJ
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11895
PNG
((2S)-2-amino-N-(cyanomethyl)-N-cyclopropyl-3,3-dim...)
Show SMILES CC(C)(C)[C@H](N)C(=O)N(CC#N)C1CC1
Show InChI InChI=1S/C11H19N3O/c1-11(2,3)9(13)10(15)14(7-6-12)8-4-5-8/h8-9H,4-5,7,13H2,1-3H3/t9-/m1/s1
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PubMed
1.31E+3 -7.94n/an/an/an/an/a7.422



Bristol-Myers Squibb Pharmaceutical Research Institute



Assay Description
Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...


Bioorg Med Chem Lett 16: 1731-4 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.098
BindingDB Entry DOI: 10.7270/Q2HD7SXP
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11899
PNG
((2S)-2-amino-N-[(1S)-1-cyanoethyl]-3,3-dimethylbut...)
Show SMILES C[C@H](NC(=O)[C@@H](N)C(C)(C)C)C#N
Show InChI InChI=1S/C9H17N3O/c1-6(5-10)12-8(13)7(11)9(2,3)4/h6-7H,11H2,1-4H3,(H,12,13)/t6-,7+/m0/s1
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PubMed
4.42E+3 -7.23n/an/an/an/an/a7.422



Bristol-Myers Squibb Pharmaceutical Research Institute



Assay Description
Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...


Bioorg Med Chem Lett 16: 1731-4 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.098
BindingDB Entry DOI: 10.7270/Q2HD7SXP
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11137
PNG
((2S)-2-amino-3-(naphthalen-2-yl)-1-(1,3-thiazolidi...)
Show SMILES N[C@@H](Cc1ccc2ccccc2c1)C(=O)N1CCSC1
Show InChI InChI=1S/C16H18N2OS/c17-15(16(19)18-7-8-20-11-18)10-12-5-6-13-3-1-2-4-14(13)9-12/h1-6,9,15H,7-8,10-11,17H2/t15-/m0/s1
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PubMed
8.90E+3 -6.89n/an/an/an/an/a7.425



Johnson & Johnson Pharmaceutical



Assay Description
The progress of DPPIV inhibition by compounds was measured by recording the liberation of free pNA at 405 nm. IC50 was determined from the slope of r...


Bioorg Med Chem Lett 16: 123-8 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.037
BindingDB Entry DOI: 10.7270/Q2S180QJ
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11898
PNG
((2S)-2-amino-N-[(1R)-1-cyanoethyl]-N,3,3-trimethyl...)
Show SMILES C[C@H](C#N)N(C)C(=O)[C@@H](N)C(C)(C)C
Show InChI InChI=1S/C10H19N3O/c1-7(6-11)13(5)9(14)8(12)10(2,3)4/h7-8H,12H2,1-5H3/t7-,8-/m1/s1
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>1.00E+4>-6.75n/an/an/an/an/a7.422



Bristol-Myers Squibb Pharmaceutical Research Institute



Assay Description
Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...


Bioorg Med Chem Lett 16: 1731-4 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.098
BindingDB Entry DOI: 10.7270/Q2HD7SXP
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11903
PNG
((2S)-2-(adamantan-1-yl)-2-amino-N-(cyanomethyl)ace...)
Show SMILES N[C@H](C(=O)NCC#N)C12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C14H21N3O/c15-1-2-17-13(18)12(16)14-6-9-3-10(7-14)5-11(4-9)8-14/h9-12H,2-8,16H2,(H,17,18)/t9?,10?,11?,12-,14?/m1/s1
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>1.00E+4>-6.75n/an/an/an/an/a7.422



Bristol-Myers Squibb Pharmaceutical Research Institute



Assay Description
Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...


Bioorg Med Chem Lett 16: 1731-4 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.098
BindingDB Entry DOI: 10.7270/Q2HD7SXP
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11909
PNG
((2S)-2-(adamantan-1-yl)-2-amino-N-benzyl-N-(cyanom...)
Show SMILES N[C@H](C(=O)N(CC#N)Cc1ccccc1)[C@@]12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C21H27N3O/c22-6-7-24(14-15-4-2-1-3-5-15)20(25)19(23)21-11-16-8-17(12-21)10-18(9-16)13-21/h1-5,16-19H,7-14,23H2/t16?,17?,18?,19-,21-/m1/s1
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>1.00E+4>-6.75n/an/an/an/an/a7.422



Bristol-Myers Squibb Pharmaceutical Research Institute



Assay Description
Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...


Bioorg Med Chem Lett 16: 1731-4 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.098
BindingDB Entry DOI: 10.7270/Q2HD7SXP
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11900
PNG
((2S)-2-amino-N-(1-cyano-1-methylethyl)-3,3-dimethy...)
Show SMILES CC(C)(C)[C@H](N)C(=O)NC(C)(C)C#N
Show InChI InChI=1S/C10H19N3O/c1-9(2,3)7(12)8(14)13-10(4,5)6-11/h7H,12H2,1-5H3,(H,13,14)/t7-/m1/s1
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>1.00E+4>-6.75n/an/an/an/an/a7.422



Bristol-Myers Squibb Pharmaceutical Research Institute



Assay Description
Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...


Bioorg Med Chem Lett 16: 1731-4 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.098
BindingDB Entry DOI: 10.7270/Q2HD7SXP
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11893
PNG
((2S)-2-amino-N-butyl-N-(cyanomethyl)-3,3-dimethylb...)
Show SMILES CCCCN(CC#N)C(=O)[C@@H](N)C(C)(C)C
Show InChI InChI=1S/C12H23N3O/c1-5-6-8-15(9-7-13)11(16)10(14)12(2,3)4/h10H,5-6,8-9,14H2,1-4H3/t10-/m1/s1
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>1.00E+4>-6.75n/an/an/an/an/a7.422



Bristol-Myers Squibb Pharmaceutical Research Institute



Assay Description
Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...


Bioorg Med Chem Lett 16: 1731-4 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.098
BindingDB Entry DOI: 10.7270/Q2HD7SXP
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11902
PNG
((2S)-2-(adamantan-1-yl)-2-amino-N-(1-cyano-1-methy...)
Show SMILES CC(C)(NC(=O)[C@@H](N)[C@@]12CC3CC(CC(C3)C1)C2)C#N
Show InChI InChI=1S/C16H25N3O/c1-15(2,9-17)19-14(20)13(18)16-6-10-3-11(7-16)5-12(4-10)8-16/h10-13H,3-8,18H2,1-2H3,(H,19,20)/t10?,11?,12?,13-,16-/m1/s1
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>1.00E+4>-6.75n/an/an/an/an/a7.422



Bristol-Myers Squibb Pharmaceutical Research Institute



Assay Description
Inhibition of human DPP-IV activity was measured under steady-state conditions by following the absorbance increase at 405 nm upon the substrate clea...


Bioorg Med Chem Lett 16: 1731-4 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.098
BindingDB Entry DOI: 10.7270/Q2HD7SXP
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11129
PNG
((2S)-2-amino-1-(2,2-dimethyl-1,3-oxazolidin-3-yl)-...)
Show SMILES CC1(C)OCCN1C(=O)[C@@H](N)Cc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C20H24N2O2/c1-20(2)22(12-13-24-20)19(23)18(21)14-15-8-10-17(11-9-15)16-6-4-3-5-7-16/h3-11,18H,12-14,21H2,1-2H3/t18-/m0/s1
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>1.28E+4>-6.67n/an/an/an/an/a7.425



Johnson & Johnson Pharmaceutical



Assay Description
The progress of DPPIV inhibition by compounds was measured by recording the liberation of free pNA at 405 nm. IC50 was determined from the slope of r...


Bioorg Med Chem Lett 16: 123-8 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.037
BindingDB Entry DOI: 10.7270/Q2S180QJ
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11128
PNG
((2S)-2-amino-1-[(2S)-2-[(benzyloxy)methyl]pyrrolid...)
Show SMILES N[C@@H](Cc1ccc(cc1)-c1ccccc1)C(=O)N1CCC[C@H]1COCc1ccccc1
Show InChI InChI=1S/C27H30N2O2/c28-26(18-21-13-15-24(16-14-21)23-10-5-2-6-11-23)27(30)29-17-7-12-25(29)20-31-19-22-8-3-1-4-9-22/h1-6,8-11,13-16,25-26H,7,12,17-20,28H2/t25-,26-/m0/s1
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>1.28E+4>-6.67n/an/an/an/an/a7.425



Johnson & Johnson Pharmaceutical



Assay Description
The progress of DPPIV inhibition by compounds was measured by recording the liberation of free pNA at 405 nm. IC50 was determined from the slope of r...


Bioorg Med Chem Lett 16: 123-8 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.037
BindingDB Entry DOI: 10.7270/Q2S180QJ
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11138
PNG
((2S)-2-amino-3-(naphthalen-1-yl)-1-(1,3-thiazolidi...)
Show SMILES N[C@@H](Cc1cccc2ccccc12)C(=O)N1CCSC1
Show InChI InChI=1S/C16H18N2OS/c17-15(16(19)18-8-9-20-11-18)10-13-6-3-5-12-4-1-2-7-14(12)13/h1-7,15H,8-11,17H2/t15-/m0/s1
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>1.28E+4>-6.67n/an/an/an/an/a7.425



Johnson & Johnson Pharmaceutical



Assay Description
The progress of DPPIV inhibition by compounds was measured by recording the liberation of free pNA at 405 nm. IC50 was determined from the slope of r...


Bioorg Med Chem Lett 16: 123-8 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.037
BindingDB Entry DOI: 10.7270/Q2S180QJ
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11139
PNG
((2S)-2-amino-3-(1H-indol-3-yl)-1-(1,3-thiazolidin-...)
Show SMILES N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCSC1
Show InChI InChI=1S/C14H17N3OS/c15-12(14(18)17-5-6-19-9-17)7-10-8-16-13-4-2-1-3-11(10)13/h1-4,8,12,16H,5-7,9,15H2/t12-/m0/s1
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>1.28E+4>-6.67n/an/an/an/an/a7.425



Johnson & Johnson Pharmaceutical



Assay Description
The progress of DPPIV inhibition by compounds was measured by recording the liberation of free pNA at 405 nm. IC50 was determined from the slope of r...


Bioorg Med Chem Lett 16: 123-8 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.037
BindingDB Entry DOI: 10.7270/Q2S180QJ
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (human))
BDBM11127
PNG
((2S)-2-amino-1-[(2S)-2-(hydroxymethyl)pyrrolidin-1...)
Show SMILES N[C@@H](Cc1ccc(cc1)-c1ccccc1)C(=O)N1CCC[C@H]1CO
Show InChI InChI=1S/C20H24N2O2/c21-19(20(24)22-12-4-7-18(22)14-23)13-15-8-10-17(11-9-15)16-5-2-1-3-6-16/h1-3,5-6,8-11,18-19,23H,4,7,12-14,21H2/t18-,19-/m0/s1
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>1.28E+4>-6.67n/an/an/an/an/a7.425



Johnson & Johnson Pharmaceutical



Assay Description
The progress of DPPIV inhibition by compounds was measured by recording the liberation of free pNA at 405 nm. IC50 was determined from the slope of r...


Bioorg Med Chem Lett 16: 123-8 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.037
BindingDB Entry DOI: 10.7270/Q2S180QJ
More data for this
Ligand-Target Pair