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Compile Data Set for Download or QSAR

Found 93 hits of ic50 for UniProtKB: P22411   
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


(Sus scrofa (pig))
BDBM50437403
PNG
(CHEMBL2408771)
Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-n1c(nc2n(-[#6])c(=O)n(-[#6]-[#6](=O)-c3ccccc3)c(=O)c12)-[#7]-1-[#6]-[#6]-2-[#6]-[#6]-[#6]-[#7]-[#6]-2-[#6]-1
Show InChI InChI=1S/C26H32N6O3/c1-17(2)11-13-31-22-23(28-25(31)30-14-19-10-7-12-27-20(19)15-30)29(3)26(35)32(24(22)34)16-21(33)18-8-5-4-6-9-18/h4-6,8-9,11,19-20,27H,7,10,12-16H2,1-3H3
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n/an/a 0.0500n/an/an/an/an/an/a



Sanofi-Aventis

Curated by ChEMBL


Assay Description
Inhibition of porcine DPP4


ACS Med Chem Lett 4: 768-72 (2013)


Article DOI: 10.1021/ml400171b
BindingDB Entry DOI: 10.7270/Q2HQ41BX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50437403
PNG
(CHEMBL2408771)
Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-n1c(nc2n(-[#6])c(=O)n(-[#6]-[#6](=O)-c3ccccc3)c(=O)c12)-[#7]-1-[#6]-[#6]-2-[#6]-[#6]-[#6]-[#7]-[#6]-2-[#6]-1
Show InChI InChI=1S/C26H32N6O3/c1-17(2)11-13-31-22-23(28-25(31)30-14-19-10-7-12-27-20(19)15-30)29(3)26(35)32(24(22)34)16-21(33)18-8-5-4-6-9-18/h4-6,8-9,11,19-20,27H,7,10,12-16H2,1-3H3
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n/an/a 0.270n/an/an/an/an/an/a



Sanofi-Aventis

Curated by ChEMBL


Assay Description
Inhibition of porcine DPP4 using H-Gly-Pro-AMC as substrate by fluorescence assay


ACS Med Chem Lett 4: 768-72 (2013)


Article DOI: 10.1021/ml400171b
BindingDB Entry DOI: 10.7270/Q2HQ41BX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50228407
PNG
(8-((R)-3-amino-piperidin-1-yl)-3-methyl-7-(3-methy...)
Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-n1c(nc2n(-[#6])c(=O)n(-[#6]-[#6](=O)-c3ccccc3)c(=O)c12)-[#7]-1-[#6]-[#6]-[#6]-[#6@@H](-[#7])-[#6]-1
Show InChI InChI=1S/C24H30N6O3/c1-16(2)11-13-29-20-21(26-23(29)28-12-7-10-18(25)14-28)27(3)24(33)30(22(20)32)15-19(31)17-8-5-4-6-9-17/h4-6,8-9,11,18H,7,10,12-15,25H2,1-3H3/t18-/m1/s1
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n/an/a 0.730n/an/an/an/an/an/a



Sanofi-Aventis

Curated by ChEMBL


Assay Description
Inhibition of porcine DPP4 using H-Gly-Pro-AMC as substrate by fluorescence assay


ACS Med Chem Lett 4: 768-72 (2013)


Article DOI: 10.1021/ml400171b
BindingDB Entry DOI: 10.7270/Q2HQ41BX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50437404
PNG
(CHEMBL2408655)
Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-n1c(nc2n(-[#6])c(=O)n(-[#6]-[#6](=O)-c3ccccc3)c(=O)c12)-[#7]-1-[#6]-[#6]-[#6]-2-[#6]-[#7]-[#6]-[#6]-1-2
Show InChI InChI=1S/C25H30N6O3/c1-16(2)9-11-30-21-22(27-24(30)29-12-10-18-13-26-14-19(18)29)28(3)25(34)31(23(21)33)15-20(32)17-7-5-4-6-8-17/h4-9,18-19,26H,10-15H2,1-3H3
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n/an/a 1n/an/an/an/an/an/a



Sanofi-Aventis

Curated by ChEMBL


Assay Description
Inhibition of porcine DPP4


ACS Med Chem Lett 4: 768-72 (2013)


Article DOI: 10.1021/ml400171b
BindingDB Entry DOI: 10.7270/Q2HQ41BX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50437404
PNG
(CHEMBL2408655)
Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-n1c(nc2n(-[#6])c(=O)n(-[#6]-[#6](=O)-c3ccccc3)c(=O)c12)-[#7]-1-[#6]-[#6]-[#6]-2-[#6]-[#7]-[#6]-[#6]-1-2
Show InChI InChI=1S/C25H30N6O3/c1-16(2)9-11-30-21-22(27-24(30)29-12-10-18-13-26-14-19(18)29)28(3)25(34)31(23(21)33)15-20(32)17-7-5-4-6-8-17/h4-9,18-19,26H,10-15H2,1-3H3
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n/an/a 1.60n/an/an/an/an/an/a



Sanofi-Aventis

Curated by ChEMBL


Assay Description
Inhibition of porcine DPP4 using H-Gly-Pro-AMC as substrate by fluorescence assay


ACS Med Chem Lett 4: 768-72 (2013)


Article DOI: 10.1021/ml400171b
BindingDB Entry DOI: 10.7270/Q2HQ41BX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50437395
PNG
(CHEMBL2408638)
Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-n1c(-[#8]-[#6]C([#6])([#6])[#6]-[#7])nc2n(-[#6])c(=O)n(-[#6]-[#6](=O)-c3ccccc3)c(=O)c12
Show InChI InChI=1S/C24H31N5O4/c1-16(2)11-12-28-19-20(26-22(28)33-15-24(3,4)14-25)27(5)23(32)29(21(19)31)13-18(30)17-9-7-6-8-10-17/h6-11H,12-15,25H2,1-5H3
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n/an/a 6.5n/an/an/an/an/an/a



Sanofi-Aventis

Curated by ChEMBL


Assay Description
Inhibition of porcine DPP4 using H-Gly-Pro-AMC as substrate by fluorescence assay


ACS Med Chem Lett 4: 768-72 (2013)


Article DOI: 10.1021/ml400171b
BindingDB Entry DOI: 10.7270/Q2HQ41BX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50437395
PNG
(CHEMBL2408638)
Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-n1c(-[#8]-[#6]C([#6])([#6])[#6]-[#7])nc2n(-[#6])c(=O)n(-[#6]-[#6](=O)-c3ccccc3)c(=O)c12
Show InChI InChI=1S/C24H31N5O4/c1-16(2)11-12-28-19-20(26-22(28)33-15-24(3,4)14-25)27(5)23(32)29(21(19)31)13-18(30)17-9-7-6-8-10-17/h6-11H,12-15,25H2,1-5H3
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n/an/a 9n/an/an/an/an/an/a



Sanofi-Aventis

Curated by ChEMBL


Assay Description
Inhibition of porcine DPP4


ACS Med Chem Lett 4: 768-72 (2013)


Article DOI: 10.1021/ml400171b
BindingDB Entry DOI: 10.7270/Q2HQ41BX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50437396
PNG
(CHEMBL2408651)
Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-n1c(-[#8]-[#6]-[#6@@H]-2-[#6]-[#6]-[#6]-[#7]-2)nc2n(-[#6])c(=O)n(-[#6]-[#6](=O)-c3ccccc3)c(=O)c12 |r|
Show InChI InChI=1S/C24H29N5O4/c1-16(2)11-13-28-20-21(26-23(28)33-15-18-10-7-12-25-18)27(3)24(32)29(22(20)31)14-19(30)17-8-5-4-6-9-17/h4-6,8-9,11,18,25H,7,10,12-15H2,1-3H3/t18-/m0/s1
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n/an/a 16n/an/an/an/an/an/a



Sanofi-Aventis

Curated by ChEMBL


Assay Description
Inhibition of porcine DPP4 using H-Gly-Pro-AMC as substrate by fluorescence assay


ACS Med Chem Lett 4: 768-72 (2013)


Article DOI: 10.1021/ml400171b
BindingDB Entry DOI: 10.7270/Q2HQ41BX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50437396
PNG
(CHEMBL2408651)
Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-n1c(-[#8]-[#6]-[#6@@H]-2-[#6]-[#6]-[#6]-[#7]-2)nc2n(-[#6])c(=O)n(-[#6]-[#6](=O)-c3ccccc3)c(=O)c12 |r|
Show InChI InChI=1S/C24H29N5O4/c1-16(2)11-13-28-20-21(26-23(28)33-15-18-10-7-12-25-18)27(3)24(32)29(22(20)31)14-19(30)17-8-5-4-6-9-17/h4-6,8-9,11,18,25H,7,10,12-15H2,1-3H3/t18-/m0/s1
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n/an/a 17n/an/an/an/an/an/a



Sanofi-Aventis

Curated by ChEMBL


Assay Description
Inhibition of porcine DPP4


ACS Med Chem Lett 4: 768-72 (2013)


Article DOI: 10.1021/ml400171b
BindingDB Entry DOI: 10.7270/Q2HQ41BX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50437402
PNG
(CHEMBL2408774)
Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-n1c(nc2n(-[#6])c(=O)n(-[#6]-[#6](=O)-c3ccccc3)c(=O)c12)-[#7]-1-[#6]-[#6]-2-[#6]-[#6]-[#7]-[#6]-2-[#6]-1
Show InChI InChI=1S/C25H30N6O3/c1-16(2)10-12-30-21-22(27-24(30)29-13-18-9-11-26-19(18)14-29)28(3)25(34)31(23(21)33)15-20(32)17-7-5-4-6-8-17/h4-8,10,18-19,26H,9,11-15H2,1-3H3
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n/an/a 17n/an/an/an/an/an/a



Sanofi-Aventis

Curated by ChEMBL


Assay Description
Inhibition of porcine DPP4


ACS Med Chem Lett 4: 768-72 (2013)


Article DOI: 10.1021/ml400171b
BindingDB Entry DOI: 10.7270/Q2HQ41BX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50228407
PNG
(8-((R)-3-amino-piperidin-1-yl)-3-methyl-7-(3-methy...)
Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-n1c(nc2n(-[#6])c(=O)n(-[#6]-[#6](=O)-c3ccccc3)c(=O)c12)-[#7]-1-[#6]-[#6]-[#6]-[#6@@H](-[#7])-[#6]-1
Show InChI InChI=1S/C24H30N6O3/c1-16(2)11-13-29-20-21(26-23(29)28-12-7-10-18(25)14-28)27(3)24(33)30(22(20)32)15-19(31)17-8-5-4-6-9-17/h4-6,8-9,11,18H,7,10,12-15,25H2,1-3H3/t18-/m1/s1
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n/an/a<40n/an/an/an/an/an/a



Sanofi-Aventis

Curated by ChEMBL


Assay Description
Inhibition of porcine DPP4 using H-Gly-Pro-AMC as substrate by fluorescence assay


ACS Med Chem Lett 4: 768-72 (2013)


Article DOI: 10.1021/ml400171b
BindingDB Entry DOI: 10.7270/Q2HQ41BX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50437402
PNG
(CHEMBL2408774)
Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-n1c(nc2n(-[#6])c(=O)n(-[#6]-[#6](=O)-c3ccccc3)c(=O)c12)-[#7]-1-[#6]-[#6]-2-[#6]-[#6]-[#7]-[#6]-2-[#6]-1
Show InChI InChI=1S/C25H30N6O3/c1-16(2)10-12-30-21-22(27-24(30)29-13-18-9-11-26-19(18)14-29)28(3)25(34)31(23(21)33)15-20(32)17-7-5-4-6-8-17/h4-8,10,18-19,26H,9,11-15H2,1-3H3
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n/an/a 57n/an/an/an/an/an/a



Sanofi-Aventis

Curated by ChEMBL


Assay Description
Inhibition of porcine DPP4 using H-Gly-Pro-AMC as substrate by fluorescence assay


ACS Med Chem Lett 4: 768-72 (2013)


Article DOI: 10.1021/ml400171b
BindingDB Entry DOI: 10.7270/Q2HQ41BX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50437398
PNG
(CHEMBL2408646)
Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-n1c(-[#8]-[#6@@H]-2-[#6]-[#6]-[#7]-[#6]-2)nc2n(-[#6])c(=O)n(-[#6]-[#6](=O)-c3ccccc3)c(=O)c12 |r|
Show InChI InChI=1S/C23H27N5O4/c1-15(2)10-12-27-19-20(25-22(27)32-17-9-11-24-13-17)26(3)23(31)28(21(19)30)14-18(29)16-7-5-4-6-8-16/h4-8,10,17,24H,9,11-14H2,1-3H3/t17-/m1/s1
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n/an/a 84n/an/an/an/an/an/a



Sanofi-Aventis

Curated by ChEMBL


Assay Description
Inhibition of porcine DPP4


ACS Med Chem Lett 4: 768-72 (2013)


Article DOI: 10.1021/ml400171b
BindingDB Entry DOI: 10.7270/Q2HQ41BX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50310584
PNG
(CHEMBL1078049 | N-(5-Chloro-pyridin-2-yl)-2-(4-{N-...)
Show SMILES NN(CC(=O)N1CSC[C@H]1C#N)C1CCN(CC(=O)Nc2ccc(Cl)cn2)CC1 |r|
Show InChI InChI=1S/C18H24ClN7O2S/c19-13-1-2-16(22-8-13)23-17(27)9-24-5-3-14(4-6-24)26(21)10-18(28)25-12-29-11-15(25)7-20/h1-2,8,14-15H,3-6,9-12,21H2,(H,22,23,27)/t15-/m1/s1
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n/an/a 88n/an/an/an/an/an/a



Torrent Pharmaceuticals Ltd.

Curated by ChEMBL


Assay Description
Inhibition of pig kidney DPP4 by spectrophotometric method


Bioorg Med Chem Lett 19: 5021-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.058
BindingDB Entry DOI: 10.7270/Q22R3RTT
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50310577
PNG
((R)-2-(4-(1-(2-(4-cyanothiazolidin-3-yl)-2-oxoethy...)
Show SMILES NN(CC(=O)N1CSC[C@H]1C#N)C1CCN(CC(=O)Nc2ccc(cc2)S(N)(=O)=O)CC1 |r|
Show InChI InChI=1S/C19H27N7O4S2/c20-9-16-12-31-13-25(16)19(28)11-26(21)15-5-7-24(8-6-15)10-18(27)23-14-1-3-17(4-2-14)32(22,29)30/h1-4,15-16H,5-8,10-13,21H2,(H,23,27)(H2,22,29,30)/t16-/m1/s1
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n/an/a 90n/an/an/an/an/an/a



Torrent Pharmaceuticals Ltd.

Curated by ChEMBL


Assay Description
Inhibition of pig kidney DPP4 by spectrophotometric method


Bioorg Med Chem Lett 19: 5021-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.058
BindingDB Entry DOI: 10.7270/Q22R3RTT
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50310577
PNG
((R)-2-(4-(1-(2-(4-cyanothiazolidin-3-yl)-2-oxoethy...)
Show SMILES NN(CC(=O)N1CSC[C@H]1C#N)C1CCN(CC(=O)Nc2ccc(cc2)S(N)(=O)=O)CC1 |r|
Show InChI InChI=1S/C19H27N7O4S2/c20-9-16-12-31-13-25(16)19(28)11-26(21)15-5-7-24(8-6-15)10-18(27)23-14-1-3-17(4-2-14)32(22,29)30/h1-4,15-16H,5-8,10-13,21H2,(H,23,27)(H2,22,29,30)/t16-/m1/s1
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n/an/a 98n/an/an/an/an/an/a



Torrent Pharmaceuticals Ltd.

Curated by ChEMBL


Assay Description
Inhibition of pig kidney DPP4 by spectrophotometric method


Bioorg Med Chem Lett 19: 5021-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.058
BindingDB Entry DOI: 10.7270/Q22R3RTT
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50310582
PNG
((R)-N-(5-cyanopyridin-2-yl)-2-(4-(1-(2-(4-cyanothi...)
Show SMILES NN(CC(=O)N1CSC[C@H]1C#N)C1CCN(CC(=O)Nc2ccc(cn2)C#N)CC1 |r|
Show InChI InChI=1S/C19H24N8O2S/c20-7-14-1-2-17(23-9-14)24-18(28)10-25-5-3-15(4-6-25)27(22)11-19(29)26-13-30-12-16(26)8-21/h1-2,9,15-16H,3-6,10-13,22H2,(H,23,24,28)/t16-/m1/s1
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n/an/a 110n/an/an/an/an/an/a



Torrent Pharmaceuticals Ltd.

Curated by ChEMBL


Assay Description
Inhibition of pig kidney DPP4 by spectrophotometric method


Bioorg Med Chem Lett 19: 5021-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.058
BindingDB Entry DOI: 10.7270/Q22R3RTT
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50310583
PNG
((R)-N-(2-chloropyridin-3-yl)-2-(4-(1-(2-(4-cyanoth...)
Show SMILES NN(CC(=O)N1CSC[C@H]1C#N)C1CCN(CC(=O)Nc2cccnc2Cl)CC1 |r|
Show InChI InChI=1S/C18H24ClN7O2S/c19-18-15(2-1-5-22-18)23-16(27)9-24-6-3-13(4-7-24)26(21)10-17(28)25-12-29-11-14(25)8-20/h1-2,5,13-14H,3-4,6-7,9-12,21H2,(H,23,27)/t14-/m1/s1
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n/an/a 119n/an/an/an/an/an/a



Torrent Pharmaceuticals Ltd.

Curated by ChEMBL


Assay Description
Inhibition of pig kidney DPP4 by spectrophotometric method


Bioorg Med Chem Lett 19: 5021-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.058
BindingDB Entry DOI: 10.7270/Q22R3RTT
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50310584
PNG
(CHEMBL1078049 | N-(5-Chloro-pyridin-2-yl)-2-(4-{N-...)
Show SMILES NN(CC(=O)N1CSC[C@H]1C#N)C1CCN(CC(=O)Nc2ccc(Cl)cn2)CC1 |r|
Show InChI InChI=1S/C18H24ClN7O2S/c19-13-1-2-16(22-8-13)23-17(27)9-24-5-3-14(4-6-24)26(21)10-18(28)25-12-29-11-15(25)7-20/h1-2,8,14-15H,3-6,9-12,21H2,(H,22,23,27)/t15-/m1/s1
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n/an/a 120n/an/an/an/an/an/a



Torrent Pharmaceuticals Ltd.

Curated by ChEMBL


Assay Description
Inhibition of pig kidney DPP4 by spectrophotometric method


Bioorg Med Chem Lett 19: 5021-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.058
BindingDB Entry DOI: 10.7270/Q22R3RTT
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50310583
PNG
((R)-N-(2-chloropyridin-3-yl)-2-(4-(1-(2-(4-cyanoth...)
Show SMILES NN(CC(=O)N1CSC[C@H]1C#N)C1CCN(CC(=O)Nc2cccnc2Cl)CC1 |r|
Show InChI InChI=1S/C18H24ClN7O2S/c19-18-15(2-1-5-22-18)23-16(27)9-24-6-3-13(4-7-24)26(21)10-17(28)25-12-29-11-14(25)8-20/h1-2,5,13-14H,3-4,6-7,9-12,21H2,(H,23,27)/t14-/m1/s1
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n/an/a 124n/an/an/an/an/an/a



Torrent Pharmaceuticals Ltd.

Curated by ChEMBL


Assay Description
Inhibition of pig kidney DPP4 by spectrophotometric method


Bioorg Med Chem Lett 19: 5021-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.058
BindingDB Entry DOI: 10.7270/Q22R3RTT
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50150851
PNG
(2-((R)-2-Amino-3-methyl-pentanoyl)-3,4-dihydro-2H-...)
Show SMILES CCC(C)[C@@H](N)C(=O)N1N=CCC1C#N |c:9|
Show InChI InChI=1S/C10H16N4O/c1-3-7(2)9(12)10(15)14-8(6-11)4-5-13-14/h5,7-9H,3-4,12H2,1-2H3/t7?,8?,9-/m1/s1
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n/an/a 130n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory concentration against dipeptidyl peptidase IV of porcine kidney


Bioorg Med Chem Lett 14: 4461-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.046
BindingDB Entry DOI: 10.7270/Q2J9674N
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50437401
PNG
(CHEMBL2408642)
Show SMILES [#6]\[#6](-[#6])=[#6]/[#6]-n1c(nc2n(-[#6])c(=O)n(-[#6])c(=O)c12)-[#7]-1-[#6]-[#6]-[#6]-2-[#6]-[#7]-[#6]-[#6]-1-2
Show InChI InChI=1S/C18H26N6O2/c1-11(2)5-7-24-14-15(21(3)18(26)22(4)16(14)25)20-17(24)23-8-6-12-9-19-10-13(12)23/h5,12-13,19H,6-10H2,1-4H3
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n/an/a 130n/an/an/an/an/an/a



Sanofi-Aventis

Curated by ChEMBL


Assay Description
Inhibition of porcine DPP4 using H-Gly-Pro-AMC as substrate by fluorescence assay


ACS Med Chem Lett 4: 768-72 (2013)


Article DOI: 10.1021/ml400171b
BindingDB Entry DOI: 10.7270/Q2HQ41BX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50310582
PNG
((R)-N-(5-cyanopyridin-2-yl)-2-(4-(1-(2-(4-cyanothi...)
Show SMILES NN(CC(=O)N1CSC[C@H]1C#N)C1CCN(CC(=O)Nc2ccc(cn2)C#N)CC1 |r|
Show InChI InChI=1S/C19H24N8O2S/c20-7-14-1-2-17(23-9-14)24-18(28)10-25-5-3-15(4-6-25)27(22)11-19(29)26-13-30-12-16(26)8-21/h1-2,9,15-16H,3-6,10-13,22H2,(H,23,24,28)/t16-/m1/s1
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n/an/a 130n/an/an/an/an/an/a



Torrent Pharmaceuticals Ltd.

Curated by ChEMBL


Assay Description
Inhibition of pig kidney DPP4 by spectrophotometric method


Bioorg Med Chem Lett 19: 5021-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.058
BindingDB Entry DOI: 10.7270/Q22R3RTT
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50310580
PNG
((R)-N-(benzo[d]thiazol-2-yl)-2-(4-(1-(2-(4-cyanoth...)
Show SMILES NN(CC(=O)N1CSC[C@H]1C#N)C1CCN(CC(=O)Nc2nc3ccccc3s2)CC1 |r|
Show InChI InChI=1S/C20H25N7O2S2/c21-9-15-12-30-13-26(15)19(29)11-27(22)14-5-7-25(8-6-14)10-18(28)24-20-23-16-3-1-2-4-17(16)31-20/h1-4,14-15H,5-8,10-13,22H2,(H,23,24,28)/t15-/m1/s1
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n/an/a 134n/an/an/an/an/an/a



Torrent Pharmaceuticals Ltd.

Curated by ChEMBL


Assay Description
Inhibition of pig kidney DPP4 by spectrophotometric method


Bioorg Med Chem Lett 19: 5021-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.058
BindingDB Entry DOI: 10.7270/Q22R3RTT
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50310581
PNG
((R)-2-(4-(1-(2-(4-cyanothiazolidin-3-yl)-2-oxoethy...)
Show SMILES NN(CC(=O)N1CSC[C@H]1C#N)C1CCN(CC(=O)Nc2ncccn2)CC1 |r|
Show InChI InChI=1S/C17H24N8O2S/c18-8-14-11-28-12-24(14)16(27)10-25(19)13-2-6-23(7-3-13)9-15(26)22-17-20-4-1-5-21-17/h1,4-5,13-14H,2-3,6-7,9-12,19H2,(H,20,21,22,26)/t14-/m1/s1
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n/an/a 143n/an/an/an/an/an/a



Torrent Pharmaceuticals Ltd.

Curated by ChEMBL


Assay Description
Inhibition of pig kidney DPP4 by spectrophotometric method


Bioorg Med Chem Lett 19: 5021-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.058
BindingDB Entry DOI: 10.7270/Q22R3RTT
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50437399
PNG
(CHEMBL2408644)
Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-n1c(-[#8]-[#6@H]-2-[#6]-[#6]-[#7]-[#6]-2)nc2n(-[#6])c(=O)n(-[#6]-[#6](=O)-c3ccccc3)c(=O)c12 |r|
Show InChI InChI=1S/C23H27N5O4/c1-15(2)10-12-27-19-20(25-22(27)32-17-9-11-24-13-17)26(3)23(31)28(21(19)30)14-18(29)16-7-5-4-6-8-16/h4-8,10,17,24H,9,11-14H2,1-3H3/t17-/m0/s1
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n/an/a 145n/an/an/an/an/an/a



Sanofi-Aventis

Curated by ChEMBL


Assay Description
Inhibition of porcine DPP4 using H-Gly-Pro-AMC as substrate by fluorescence assay


ACS Med Chem Lett 4: 768-72 (2013)


Article DOI: 10.1021/ml400171b
BindingDB Entry DOI: 10.7270/Q2HQ41BX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50437398
PNG
(CHEMBL2408646)
Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-n1c(-[#8]-[#6@@H]-2-[#6]-[#6]-[#7]-[#6]-2)nc2n(-[#6])c(=O)n(-[#6]-[#6](=O)-c3ccccc3)c(=O)c12 |r|
Show InChI InChI=1S/C23H27N5O4/c1-15(2)10-12-27-19-20(25-22(27)32-17-9-11-24-13-17)26(3)23(31)28(21(19)30)14-18(29)16-7-5-4-6-8-16/h4-8,10,17,24H,9,11-14H2,1-3H3/t17-/m1/s1
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n/an/a 147n/an/an/an/an/an/a



Sanofi-Aventis

Curated by ChEMBL


Assay Description
Inhibition of porcine DPP4 using H-Gly-Pro-AMC as substrate by fluorescence assay


ACS Med Chem Lett 4: 768-72 (2013)


Article DOI: 10.1021/ml400171b
BindingDB Entry DOI: 10.7270/Q2HQ41BX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50310579
PNG
((R)-2-(4-(1-(2-(4-cyanothiazolidin-3-yl)-2-oxoethy...)
Show SMILES Cc1nc(NC(=O)CN2CCC(CC2)N(N)CC(=O)N2CSC[C@H]2C#N)sc1C |r|
Show InChI InChI=1S/C18H27N7O2S2/c1-12-13(2)29-18(21-12)22-16(26)8-23-5-3-14(4-6-23)25(20)9-17(27)24-11-28-10-15(24)7-19/h14-15H,3-6,8-11,20H2,1-2H3,(H,21,22,26)/t15-/m1/s1
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Torrent Pharmaceuticals Ltd.

Curated by ChEMBL


Assay Description
Inhibition of pig kidney DPP4 by spectrophotometric method


Bioorg Med Chem Lett 19: 5021-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.058
BindingDB Entry DOI: 10.7270/Q22R3RTT
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50310576
PNG
((R)-N-(4-cyanophenyl)-2-(4-(1-(2-(4-cyanothiazolid...)
Show SMILES NN(CC(=O)N1CSC[C@H]1C#N)C1CCN(CC(=O)Nc2ccc(cc2)C#N)CC1 |r|
Show InChI InChI=1S/C20H25N7O2S/c21-9-15-1-3-16(4-2-15)24-19(28)11-25-7-5-17(6-8-25)27(23)12-20(29)26-14-30-13-18(26)10-22/h1-4,17-18H,5-8,11-14,23H2,(H,24,28)/t18-/m1/s1
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Torrent Pharmaceuticals Ltd.

Curated by ChEMBL


Assay Description
Inhibition of pig kidney DPP4 by spectrophotometric method


Bioorg Med Chem Lett 19: 5021-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.058
BindingDB Entry DOI: 10.7270/Q22R3RTT
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50437401
PNG
(CHEMBL2408642)
Show SMILES [#6]\[#6](-[#6])=[#6]/[#6]-n1c(nc2n(-[#6])c(=O)n(-[#6])c(=O)c12)-[#7]-1-[#6]-[#6]-[#6]-2-[#6]-[#7]-[#6]-[#6]-1-2
Show InChI InChI=1S/C18H26N6O2/c1-11(2)5-7-24-14-15(21(3)18(26)22(4)16(14)25)20-17(24)23-8-6-12-9-19-10-13(12)23/h5,12-13,19H,6-10H2,1-4H3
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n/an/a 210n/an/an/an/an/an/a



Sanofi-Aventis

Curated by ChEMBL


Assay Description
Inhibition of porcine DPP4


ACS Med Chem Lett 4: 768-72 (2013)


Article DOI: 10.1021/ml400171b
BindingDB Entry DOI: 10.7270/Q2HQ41BX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50310568
PNG
((R)-2-(4-(1-(2-(4-cyanothiazolidin-3-yl)-2-oxoethy...)
Show SMILES NN(CC(=O)N1CSC[C@H]1C#N)C1CCN(CC(=O)NC2CC2)CC1 |r|
Show InChI InChI=1S/C16H26N6O2S/c17-7-14-10-25-11-21(14)16(24)9-22(18)13-3-5-20(6-4-13)8-15(23)19-12-1-2-12/h12-14H,1-6,8-11,18H2,(H,19,23)/t14-/m1/s1
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Torrent Pharmaceuticals Ltd.

Curated by ChEMBL


Assay Description
Inhibition of pig kidney DPP4 by spectrophotometric method


Bioorg Med Chem Lett 19: 5021-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.058
BindingDB Entry DOI: 10.7270/Q22R3RTT
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50310575
PNG
((R)-2-(4-(1-(2-(4-cyanothiazolidin-3-yl)-2-oxoethy...)
Show SMILES NN(CC(=O)N1CSC[C@H]1C#N)C1CCN(CC(=O)Nc2ccc3OCCOc3c2)CC1 |r|
Show InChI InChI=1S/C21H28N6O4S/c22-10-17-13-32-14-26(17)21(29)12-27(23)16-3-5-25(6-4-16)11-20(28)24-15-1-2-18-19(9-15)31-8-7-30-18/h1-2,9,16-17H,3-8,11-14,23H2,(H,24,28)/t17-/m1/s1
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Torrent Pharmaceuticals Ltd.

Curated by ChEMBL


Assay Description
Inhibition of pig kidney DPP4 by spectrophotometric method


Bioorg Med Chem Lett 19: 5021-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.058
BindingDB Entry DOI: 10.7270/Q22R3RTT
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50310578
PNG
((R)-N-(5-bromothiazol-2-yl)-2-(4-(1-(2-(4-cyanothi...)
Show SMILES NN(CC(=O)N1CSC[C@H]1C#N)C1CCN(CC(=O)Nc2ncc(Br)s2)CC1 |r|
Show InChI InChI=1S/C16H22BrN7O2S2/c17-13-6-20-16(28-13)21-14(25)7-22-3-1-11(2-4-22)24(19)8-15(26)23-10-27-9-12(23)5-18/h6,11-12H,1-4,7-10,19H2,(H,20,21,25)/t12-/m1/s1
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Torrent Pharmaceuticals Ltd.

Curated by ChEMBL


Assay Description
Inhibition of pig kidney DPP4 by spectrophotometric method


Bioorg Med Chem Lett 19: 5021-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.058
BindingDB Entry DOI: 10.7270/Q22R3RTT
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50310568
PNG
((R)-2-(4-(1-(2-(4-cyanothiazolidin-3-yl)-2-oxoethy...)
Show SMILES NN(CC(=O)N1CSC[C@H]1C#N)C1CCN(CC(=O)NC2CC2)CC1 |r|
Show InChI InChI=1S/C16H26N6O2S/c17-7-14-10-25-11-21(14)16(24)9-22(18)13-3-5-20(6-4-13)8-15(23)19-12-1-2-12/h12-14H,1-6,8-11,18H2,(H,19,23)/t14-/m1/s1
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Torrent Pharmaceuticals Ltd.

Curated by ChEMBL


Assay Description
Inhibition of pig kidney DPP4 by spectrophotometric method


Bioorg Med Chem Lett 19: 5021-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.058
BindingDB Entry DOI: 10.7270/Q22R3RTT
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50310574
PNG
((R)-N-(benzo[d][1,3]dioxol-5-yl)-2-(4-(1-(2-(4-cya...)
Show SMILES NN(CC(=O)N1CSC[C@H]1C#N)C1CCN(CC(=O)Nc2ccc3OCOc3c2)CC1 |r|
Show InChI InChI=1S/C20H26N6O4S/c21-8-16-11-31-12-25(16)20(28)10-26(22)15-3-5-24(6-4-15)9-19(27)23-14-1-2-17-18(7-14)30-13-29-17/h1-2,7,15-16H,3-6,9-13,22H2,(H,23,27)/t16-/m1/s1
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Torrent Pharmaceuticals Ltd.

Curated by ChEMBL


Assay Description
Inhibition of pig kidney DPP4 by spectrophotometric method


Bioorg Med Chem Lett 19: 5021-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.058
BindingDB Entry DOI: 10.7270/Q22R3RTT
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50310571
PNG
((R)-N-(4-chlorophenyl)-2-(4-(1-(2-(4-cyanothiazoli...)
Show SMILES NN(CC(=O)N1CSC[C@H]1C#N)C1CCN(CC(=O)Nc2ccc(Cl)cc2)CC1 |r|
Show InChI InChI=1S/C19H25ClN6O2S/c20-14-1-3-15(4-2-14)23-18(27)10-24-7-5-16(6-8-24)26(22)11-19(28)25-13-29-12-17(25)9-21/h1-4,16-17H,5-8,10-13,22H2,(H,23,27)/t17-/m1/s1
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n/an/a 258n/an/an/an/an/an/a



Torrent Pharmaceuticals Ltd.

Curated by ChEMBL


Assay Description
Inhibition of pig kidney DPP4 by spectrophotometric method


Bioorg Med Chem Lett 19: 5021-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.058
BindingDB Entry DOI: 10.7270/Q22R3RTT
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50437400
PNG
(CHEMBL2408643)
Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-n1c(-[#8]-[#6]-2-[#6]-[#6]-[#7]-[#6]-[#6]-2)nc2n(-[#6])c(=O)n(-[#6]-[#6](=O)-c3ccccc3)c(=O)c12
Show InChI InChI=1S/C24H29N5O4/c1-16(2)11-14-28-20-21(26-23(28)33-18-9-12-25-13-10-18)27(3)24(32)29(22(20)31)15-19(30)17-7-5-4-6-8-17/h4-8,11,18,25H,9-10,12-15H2,1-3H3
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n/an/a 275n/an/an/an/an/an/a



Sanofi-Aventis

Curated by ChEMBL


Assay Description
Inhibition of porcine DPP4 using H-Gly-Pro-AMC as substrate by fluorescence assay


ACS Med Chem Lett 4: 768-72 (2013)


Article DOI: 10.1021/ml400171b
BindingDB Entry DOI: 10.7270/Q2HQ41BX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50310573
PNG
((R)-2-(4-(1-(2-(4-cyanothiazolidin-3-yl)-2-oxoethy...)
Show SMILES NN(CC(=O)N1CSC[C@H]1C#N)C1CCN(CC(=O)Nc2ccc(cc2)C(F)(F)F)CC1 |r|
Show InChI InChI=1S/C20H25F3N6O2S/c21-20(22,23)14-1-3-15(4-2-14)26-18(30)10-27-7-5-16(6-8-27)29(25)11-19(31)28-13-32-12-17(28)9-24/h1-4,16-17H,5-8,10-13,25H2,(H,26,30)/t17-/m1/s1
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n/an/a 308n/an/an/an/an/an/a



Torrent Pharmaceuticals Ltd.

Curated by ChEMBL


Assay Description
Inhibition of pig kidney DPP4 by spectrophotometric method


Bioorg Med Chem Lett 19: 5021-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.058
BindingDB Entry DOI: 10.7270/Q22R3RTT
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50437399
PNG
(CHEMBL2408644)
Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-n1c(-[#8]-[#6@H]-2-[#6]-[#6]-[#7]-[#6]-2)nc2n(-[#6])c(=O)n(-[#6]-[#6](=O)-c3ccccc3)c(=O)c12 |r|
Show InChI InChI=1S/C23H27N5O4/c1-15(2)10-12-27-19-20(25-22(27)32-17-9-11-24-13-17)26(3)23(31)28(21(19)30)14-18(29)16-7-5-4-6-8-16/h4-8,10,17,24H,9,11-14H2,1-3H3/t17-/m0/s1
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n/an/a 334n/an/an/an/an/an/a



Sanofi-Aventis

Curated by ChEMBL


Assay Description
Inhibition of porcine DPP4


ACS Med Chem Lett 4: 768-72 (2013)


Article DOI: 10.1021/ml400171b
BindingDB Entry DOI: 10.7270/Q2HQ41BX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50310572
PNG
((R)-N-(3-chloro-4-fluorophenyl)-2-(4-(1-(2-(4-cyan...)
Show SMILES NN(CC(=O)N1CSC[C@H]1C#N)C1CCN(CC(=O)Nc2ccc(F)c(Cl)c2)CC1 |r|
Show InChI InChI=1S/C19H24ClFN6O2S/c20-16-7-13(1-2-17(16)21)24-18(28)9-25-5-3-14(4-6-25)27(23)10-19(29)26-12-30-11-15(26)8-22/h1-2,7,14-15H,3-6,9-12,23H2,(H,24,28)/t15-/m1/s1
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n/an/a 359n/an/an/an/an/an/a



Torrent Pharmaceuticals Ltd.

Curated by ChEMBL


Assay Description
Inhibition of pig kidney DPP4 by spectrophotometric method


Bioorg Med Chem Lett 19: 5021-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.058
BindingDB Entry DOI: 10.7270/Q22R3RTT
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM11559
PNG
(N-({(2S)-1-[(3R)-3-amino-4-(2-fluorophenyl)butanoy...)
Show SMILES N[C@@H](CC(=O)N1CCC[C@H]1CNC(=O)c1ccccc1)Cc1ccccc1F |r|
Show InChI InChI=1S/C22H26FN3O2/c23-20-11-5-4-9-17(20)13-18(24)14-21(27)26-12-6-10-19(26)15-25-22(28)16-7-2-1-3-8-16/h1-5,7-9,11,18-19H,6,10,12-15,24H2,(H,25,28)/t18-,19+/m1/s1
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n/an/a 410n/an/an/an/a7.425



Santhera Pharmaceuticals



Assay Description
The DPP4 activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 370 nm and mea...


Bioorg Med Chem Lett 16: 1744-8 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.103
BindingDB Entry DOI: 10.7270/Q2639MZX
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50310569
PNG
((R)-2-(4-(1-(2-(4-cyanothiazolidin-3-yl)-2-oxoethy...)
Show SMILES NN(CC(=O)N1CSC[C@H]1C#N)C1CCN(CC(=O)NCCc2cccs2)CC1 |r|
Show InChI InChI=1S/C19H28N6O2S2/c20-10-16-13-28-14-24(16)19(27)12-25(21)15-4-7-23(8-5-15)11-18(26)22-6-3-17-2-1-9-29-17/h1-2,9,15-16H,3-8,11-14,21H2,(H,22,26)/t16-/m1/s1
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n/an/a 415n/an/an/an/an/an/a



Torrent Pharmaceuticals Ltd.

Curated by ChEMBL


Assay Description
Inhibition of pig kidney DPP4 by spectrophotometric method


Bioorg Med Chem Lett 19: 5021-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.058
BindingDB Entry DOI: 10.7270/Q22R3RTT
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50049394
PNG
(5,4'-Dihydroxy-6,7-dimethoxyflavone | 5-Hydroxy-2-...)
Show SMILES COc1cc2oc(cc(=O)c2c(O)c1OC)-c1ccc(O)cc1
Show InChI InChI=1S/C17H14O6/c1-21-14-8-13-15(16(20)17(14)22-2)11(19)7-12(23-13)9-3-5-10(18)6-4-9/h3-8,18,20H,1-2H3
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n/an/a 430n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of porcine DPP4 after 30 mins by luminescence assay


Eur J Med Chem 151: 145-157 (2018)


Article DOI: 10.1016/j.ejmech.2018.03.041
BindingDB Entry DOI: 10.7270/Q2CZ39SV
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50150858
PNG
(6-{2-[2-((S)-5-Cyano-4,5-dihydro-pyrazol-1-yl)-2-o...)
Show SMILES O=C(CNCCNc1ccc(cn1)C#N)N1N=CC[C@H]1C#N |c:17|
Show InChI InChI=1S/C14H15N7O/c15-7-11-1-2-13(19-9-11)18-6-5-17-10-14(22)21-12(8-16)3-4-20-21/h1-2,4,9,12,17H,3,5-6,10H2,(H,18,19)/t12-/m0/s1
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n/an/a 440n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory concentration against dipeptidyl peptidase IV of porcine kidney


Bioorg Med Chem Lett 14: 4461-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.046
BindingDB Entry DOI: 10.7270/Q2J9674N
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50310565
PNG
((R)-2-(4-(1-(2-(4-cyanothiazolidin-3-yl)-2-oxoethy...)
Show SMILES CC(C)OCCCNC(=O)CN1CCC(CC1)N(N)CC(=O)N1CSC[C@H]1C#N |r|
Show InChI InChI=1S/C19H34N6O3S/c1-15(2)28-9-3-6-22-18(26)11-23-7-4-16(5-8-23)25(21)12-19(27)24-14-29-13-17(24)10-20/h15-17H,3-9,11-14,21H2,1-2H3,(H,22,26)/t17-/m1/s1
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Torrent Pharmaceuticals Ltd.

Curated by ChEMBL


Assay Description
Inhibition of pig kidney DPP4 by spectrophotometric method


Bioorg Med Chem Lett 19: 5021-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.058
BindingDB Entry DOI: 10.7270/Q22R3RTT
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50310589
PNG
((R)-N-(5-chloropyridin-2-yl)-2-(4-(1-(2-(4-cyanoth...)
Show SMILES CCNN(CC(=O)N1CSC[C@H]1C#N)C1CCN(CC(=O)Nc2ccc(Cl)cn2)CC1 |r|
Show InChI InChI=1S/C20H28ClN7O2S/c1-2-24-28(12-20(30)27-14-31-13-17(27)9-22)16-5-7-26(8-6-16)11-19(29)25-18-4-3-15(21)10-23-18/h3-4,10,16-17,24H,2,5-8,11-14H2,1H3,(H,23,25,29)/t17-/m1/s1
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n/an/a 490n/an/an/an/an/an/a



Torrent Pharmaceuticals Ltd.

Curated by ChEMBL


Assay Description
Inhibition of pig kidney DPP4 by spectrophotometric method


Bioorg Med Chem Lett 19: 5021-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.058
BindingDB Entry DOI: 10.7270/Q22R3RTT
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50049395
PNG
(5,7,4'-Trihydroxy-6-methoxyflavone | 5,7-Dihydroxy...)
Show SMILES COc1c(O)cc2oc(cc(=O)c2c1O)-c1ccc(O)cc1
Show InChI InChI=1S/C16H12O6/c1-21-16-11(19)7-13-14(15(16)20)10(18)6-12(22-13)8-2-4-9(17)5-3-8/h2-7,17,19-20H,1H3
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n/an/a 490n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of porcine DPP4 after 30 mins by luminescence assay


Eur J Med Chem 151: 145-157 (2018)


Article DOI: 10.1016/j.ejmech.2018.03.041
BindingDB Entry DOI: 10.7270/Q2CZ39SV
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50150854
PNG
(6-(2-(2-(5-cyano-4,5-dihydro-1H-pyrazol-1-yl)-2-ox...)
Show SMILES O=C(CNCCNc1ccc(cn1)C#N)N1N=CCC1C#N |c:17|
Show InChI InChI=1S/C14H15N7O/c15-7-11-1-2-13(19-9-11)18-6-5-17-10-14(22)21-12(8-16)3-4-20-21/h1-2,4,9,12,17H,3,5-6,10H2,(H,18,19)
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n/an/a 490n/an/an/an/an/an/a



Matrix Laboratories Limited

Curated by ChEMBL


Assay Description
Inhibition of pig kidney DPP4


Bioorg Med Chem 17: 1783-802 (2009)


Article DOI: 10.1016/j.bmc.2009.01.061
BindingDB Entry DOI: 10.7270/Q2VD70DJ
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50310567
PNG
((R)-2-(4-(1-(2-(4-cyanothiazolidin-3-yl)-2-oxoethy...)
Show SMILES NN(CC(=O)N1CSC[C@H]1C#N)C1CCN(CC(=O)NC2CCCCC2)CC1 |r|
Show InChI InChI=1S/C19H32N6O2S/c20-10-17-13-28-14-24(17)19(27)12-25(21)16-6-8-23(9-7-16)11-18(26)22-15-4-2-1-3-5-15/h15-17H,1-9,11-14,21H2,(H,22,26)/t17-/m1/s1
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n/an/a 506n/an/an/an/an/an/a



Torrent Pharmaceuticals Ltd.

Curated by ChEMBL


Assay Description
Inhibition of pig kidney DPP4 by spectrophotometric method


Bioorg Med Chem Lett 19: 5021-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.058
BindingDB Entry DOI: 10.7270/Q22R3RTT
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Sus scrofa (pig))
BDBM50310570
PNG
((R)-2-(4-(1-(2-(4-cyanothiazolidin-3-yl)-2-oxoethy...)
Show SMILES NN(CC(=O)N1CSC[C@H]1C#N)C1CCN(CC(=O)NCc2ccccc2F)CC1 |r|
Show InChI InChI=1S/C20H27FN6O2S/c21-18-4-2-1-3-15(18)10-24-19(28)11-25-7-5-16(6-8-25)27(23)12-20(29)26-14-30-13-17(26)9-22/h1-4,16-17H,5-8,10-14,23H2,(H,24,28)/t17-/m1/s1
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Torrent Pharmaceuticals Ltd.

Curated by ChEMBL


Assay Description
Inhibition of pig kidney DPP4 by spectrophotometric method


Bioorg Med Chem Lett 19: 5021-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.058
BindingDB Entry DOI: 10.7270/Q22R3RTT
More data for this
Ligand-Target Pair
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