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PubMed code 21218817

Compile data set for download or QSAR
Found 52 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM50336806
PNG
(1-(3-(aminomethyl)-2-isobutyl-4-p-tolylquinolin-6-...)
Show SMILES CC(C)Cc1nc2ccc(cc2c(-c2ccc(C)cc2)c1CN)N1CC(=O)NCC1=O
Show InChI InChI=1S/C25H28N4O2/c1-15(2)10-22-20(12-26)25(17-6-4-16(3)5-7-17)19-11-18(8-9-21(19)28-22)29-14-23(30)27-13-24(29)31/h4-9,11,15H,10,12-14,26H2,1-3H3,(H,27,30)
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n/an/a 1.10n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of DPP4 in human Caco2 cells after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM50336818
PNG
(5-(Aminomethyl)-2-benzyl-6-(2,2-dimethylpropyl)-4-...)
Show SMILES Cc1ccc(cc1)-c1c(CN)c(CC(C)(C)C)nc(Cc2ccccc2)c1C(O)=O
Show InChI InChI=1S/C26H30N2O2/c1-17-10-12-19(13-11-17)23-20(16-27)22(15-26(2,3)4)28-21(24(23)25(29)30)14-18-8-6-5-7-9-18/h5-13H,14-16,27H2,1-4H3,(H,29,30)
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n/an/a 2.5n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of DPP4 in human Caco2 cells after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM50336815
PNG
(5-(Aminomethyl)-6-(2,2-dimethylpropyl)-4-(4-methyl...)
Show SMILES CCCc1nc(CC(C)(C)C)c(CN)c(-c2ccc(C)cc2)c1C(O)=O
Show InChI InChI=1S/C22H30N2O2/c1-6-7-17-20(21(25)26)19(15-10-8-14(2)9-11-15)16(13-23)18(24-17)12-22(3,4)5/h8-11H,6-7,12-13,23H2,1-5H3,(H,25,26)
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n/an/a 4.40n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of DPP4 in human Caco2 cells after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM50336817
PNG
(5-(Aminomethyl)-6-(2,2-dimethylpropyl)-4-(4-methyl...)
Show SMILES CC(C)Cc1nc(CC(C)(C)C)c(CN)c(-c2ccc(C)cc2)c1C(O)=O
Show InChI InChI=1S/C23H32N2O2/c1-14(2)11-18-21(22(26)27)20(16-9-7-15(3)8-10-16)17(13-24)19(25-18)12-23(4,5)6/h7-10,14H,11-13,24H2,1-6H3,(H,26,27)
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n/an/a 4.60n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of DPP4 in human Caco2 cells after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM50336820
PNG
(CHEMBL1672127 | [5-(Aminomethyl)-6-(2,2-dimethylpr...)
Show SMILES CCc1nc(CC(C)(C)C)c(CN)c(-c2ccc(C)cc2)c1CC(O)=O
Show InChI InChI=1S/C22H30N2O2/c1-6-18-16(11-20(25)26)21(15-9-7-14(2)8-10-15)17(13-23)19(24-18)12-22(3,4)5/h7-10H,6,11-13,23H2,1-5H3,(H,25,26)
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n/an/a 5.30n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of DPP4 in human Caco2 cells after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM50336814
PNG
(5-(Aminomethyl)-6-(2,2-dimethylpropyl)-2-ethyl-4-(...)
Show SMILES CCc1nc(CC(C)(C)C)c(CN)c(-c2ccc(C)cc2)c1C(O)=O
Show InChI InChI=1S/C21H28N2O2/c1-6-16-19(20(24)25)18(14-9-7-13(2)8-10-14)15(12-22)17(23-16)11-21(3,4)5/h7-10H,6,11-12,22H2,1-5H3,(H,24,25)
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n/an/a 5.70n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of DPP4 in human Caco2 cells after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM50336805
PNG
(6-[3-(Aminomethyl)-4-(4-methylphenyl)-2-(2-methylp...)
Show SMILES CC(C)Cc1nc2ccc(CCCCCC(O)=O)cc2c(-c2ccc(C)cc2)c1CN
Show InChI InChI=1S/C27H34N2O2/c1-18(2)15-25-23(17-28)27(21-12-9-19(3)10-13-21)22-16-20(11-14-24(22)29-25)7-5-4-6-8-26(30)31/h9-14,16,18H,4-8,15,17,28H2,1-3H3,(H,30,31)
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n/an/a 6.60n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of DPP4 in human Caco2 cells after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM50336803
PNG
(4-[3-(Aminomethyl)-4-(4-methylphenyl)-2-(2-methylp...)
Show SMILES CC(C)Cc1nc2ccc(CCCC(O)=O)cc2c(-c2ccc(C)cc2)c1CN
Show InChI InChI=1S/C25H30N2O2/c1-16(2)13-23-21(15-26)25(19-10-7-17(3)8-11-19)20-14-18(5-4-6-24(28)29)9-12-22(20)27-23/h7-12,14,16H,4-6,13,15,26H2,1-3H3,(H,28,29)
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n/an/a 8.70n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of DPP4 in human Caco2 cells after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM50336804
PNG
(5-[3-(Aminomethyl)-4-(4-methylphenyl)-2-(2-methylp...)
Show SMILES CC(C)Cc1nc2ccc(CCCCC(O)=O)cc2c(-c2ccc(C)cc2)c1CN
Show InChI InChI=1S/C26H32N2O2/c1-17(2)14-24-22(16-27)26(20-11-8-18(3)9-12-20)21-15-19(10-13-23(21)28-24)6-4-5-7-25(29)30/h8-13,15,17H,4-7,14,16,27H2,1-3H3,(H,29,30)
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n/an/a 9.60n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of DPP4 in human Caco2 cells after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM50336819
PNG
(CHEMBL1672126 | [5-(Aminomethyl)-6-(2,2-dimethylpr...)
Show SMILES Cc1ccc(cc1)-c1c(CN)c(CC(C)(C)C)nc(C)c1CC(O)=O
Show InChI InChI=1S/C21H28N2O2/c1-13-6-8-15(9-7-13)20-16(10-19(24)25)14(2)23-18(17(20)12-22)11-21(3,4)5/h6-9H,10-12,22H2,1-5H3,(H,24,25)
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n/an/a 10n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of DPP4 in human Caco2 cells after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM50333184
PNG
(5-(aminomethyl)-2-methyl-4-(4-methylphenyl)-6-(2-m...)
Show SMILES CC(C)Cc1nc(C)c(C(O)=O)c(-c2ccc(C)cc2)c1CN
Show InChI InChI=1S/C19H24N2O2/c1-11(2)9-16-15(10-20)18(14-7-5-12(3)6-8-14)17(19(22)23)13(4)21-16/h5-8,11H,9-10,20H2,1-4H3,(H,22,23)
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n/an/a 18n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of DPP4 in human Caco2 cells after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM50336813
PNG
(5-(Aminomethyl)-6-(2,2-dimethylpropyl)-2-methyl-4-...)
Show SMILES Cc1ccc(cc1)-c1c(CN)c(CC(C)(C)C)nc(C)c1C(O)=O
Show InChI InChI=1S/C20H26N2O2/c1-12-6-8-14(9-7-12)18-15(11-21)16(10-20(3,4)5)22-13(2)17(18)19(23)24/h6-9H,10-11,21H2,1-5H3,(H,23,24)
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n/an/a 18n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of DPP4 in human Caco2 cells after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM50336816
PNG
(5-(Aminomethyl)-6-(2,2-dimethylpropyl)-2-(1-methyl...)
Show SMILES CC(C)c1nc(CC(C)(C)C)c(CN)c(-c2ccc(C)cc2)c1C(O)=O
Show InChI InChI=1S/C22H30N2O2/c1-13(2)20-19(21(25)26)18(15-9-7-14(3)8-10-15)16(12-23)17(24-20)11-22(4,5)6/h7-10,13H,11-12,23H2,1-6H3,(H,25,26)
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n/an/a 19n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of DPP4 in human Caco2 cells after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM50336808
PNG
(CHEMBL1672115 | [5-(Aminomethyl)-2-methyl-4-(4-met...)
Show SMILES CC(C)Cc1nc(C)c(CC(O)=O)c(-c2ccc(C)cc2)c1CN
Show InChI InChI=1S/C20H26N2O2/c1-12(2)9-18-17(11-21)20(15-7-5-13(3)6-8-15)16(10-19(23)24)14(4)22-18/h5-8,12H,9-11,21H2,1-4H3,(H,23,24)
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n/an/a 20n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of DPP4 in human Caco2 cells after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM50336802
PNG
(3-[3-(Aminomethyl)-4-(4-methylphenyl)-2-(2-methylp...)
Show SMILES CC(C)Cc1nc2ccc(CCC(O)=O)cc2c(-c2ccc(C)cc2)c1CN
Show InChI InChI=1S/C24H28N2O2/c1-15(2)12-22-20(14-25)24(18-8-4-16(3)5-9-18)19-13-17(7-11-23(27)28)6-10-21(19)26-22/h4-6,8-10,13,15H,7,11-12,14,25H2,1-3H3,(H,27,28)
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n/an/a 23n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of DPP4 in human Caco2 cells after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM50336809
PNG
(3-[5-(Aminomethyl)-2-methyl-4-(4-methylphenyl)-6-(...)
Show SMILES CC(C)Cc1nc(C)c(CCC(O)=O)c(-c2ccc(C)cc2)c1CN
Show InChI InChI=1S/C21H28N2O2/c1-13(2)11-19-18(12-22)21(16-7-5-14(3)6-8-16)17(15(4)23-19)9-10-20(24)25/h5-8,13H,9-12,22H2,1-4H3,(H,24,25)
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n/an/a 39n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of DPP4 in human Caco2 cells after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM50336811
PNG
(5-(Aminomethyl)-2-methyl-4-(4-methylphenyl)-6-prop...)
Show SMILES CCCc1nc(C)c(C(O)=O)c(-c2ccc(C)cc2)c1CN
Show InChI InChI=1S/C18H22N2O2/c1-4-5-15-14(10-19)17(13-8-6-11(2)7-9-13)16(18(21)22)12(3)20-15/h6-9H,4-5,10,19H2,1-3H3,(H,21,22)
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n/an/a 57n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of DPP4 in human Caco2 cells after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM50336812
PNG
(5-(Aminomethyl)-6-butyl-2-methyl-4-(4-methylphenyl...)
Show SMILES CCCCc1nc(C)c(C(O)=O)c(-c2ccc(C)cc2)c1CN
Show InChI InChI=1S/C19H24N2O2/c1-4-5-6-16-15(11-20)18(14-9-7-12(2)8-10-14)17(19(22)23)13(3)21-16/h7-10H,4-6,11,20H2,1-3H3,(H,22,23)
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n/an/a 58n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of DPP4 in human Caco2 cells after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM50336810
PNG
((2E)-3-[5-(Aminomethyl)-2-methyl-4-(4-methylphenyl...)
Show SMILES CC(C)Cc1nc(C)c(\C=C\C(O)=O)c(-c2ccc(C)cc2)c1CN
Show InChI InChI=1S/C21H26N2O2/c1-13(2)11-19-18(12-22)21(16-7-5-14(3)6-8-16)17(15(4)23-19)9-10-20(24)25/h5-10,13H,11-12,22H2,1-4H3,(H,24,25)/b10-9+
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n/an/a 66n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of DPP4 in human Caco2 cells after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase II


(Rattus norvegicus)
BDBM50336818
PNG
(5-(Aminomethyl)-2-benzyl-6-(2,2-dimethylpropyl)-4-...)
Show SMILES Cc1ccc(cc1)-c1c(CN)c(CC(C)(C)C)nc(Cc2ccccc2)c1C(O)=O
Show InChI InChI=1S/C26H30N2O2/c1-17-10-12-19(13-11-17)23-20(16-27)22(15-26(2,3)4)28-21(24(23)25(29)30)14-18-8-6-5-7-9-18/h5-13H,14-16,27H2,1-4H3,(H,29,30)
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n/an/a 250n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of rat kidney DPP2 after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (human))
BDBM50336817
PNG
(5-(Aminomethyl)-6-(2,2-dimethylpropyl)-4-(4-methyl...)
Show SMILES CC(C)Cc1nc(CC(C)(C)C)c(CN)c(-c2ccc(C)cc2)c1C(O)=O
Show InChI InChI=1S/C23H32N2O2/c1-14(2)11-18-21(22(26)27)20(16-9-7-15(3)8-10-16)17(13-24)19(25-18)12-23(4,5)6/h7-10,14H,11-13,24H2,1-6H3,(H,26,27)
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n/an/a 420n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of FLAG-tagged human DPP8 expressed in human 293F cells after 90 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (human))
BDBM50336815
PNG
(5-(Aminomethyl)-6-(2,2-dimethylpropyl)-4-(4-methyl...)
Show SMILES CCCc1nc(CC(C)(C)C)c(CN)c(-c2ccc(C)cc2)c1C(O)=O
Show InChI InChI=1S/C22H30N2O2/c1-6-7-17-20(21(25)26)19(15-10-8-14(2)9-11-15)16(13-23)18(24-17)12-22(3,4)5/h8-11H,6-7,12-13,23H2,1-5H3,(H,25,26)
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n/an/a 630n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of FLAG-tagged human DPP8 expressed in human 293F cells after 90 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (human))
BDBM50336814
PNG
(5-(Aminomethyl)-6-(2,2-dimethylpropyl)-2-ethyl-4-(...)
Show SMILES CCc1nc(CC(C)(C)C)c(CN)c(-c2ccc(C)cc2)c1C(O)=O
Show InChI InChI=1S/C21H28N2O2/c1-6-16-19(20(24)25)18(14-9-7-13(2)8-10-14)15(12-22)17(23-16)11-21(3,4)5/h7-10H,6,11-12,22H2,1-5H3,(H,24,25)
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n/an/a 820n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of FLAG-tagged human DPP8 expressed in human 293F cells after 90 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase II


(Rattus norvegicus)
BDBM50336809
PNG
(3-[5-(Aminomethyl)-2-methyl-4-(4-methylphenyl)-6-(...)
Show SMILES CC(C)Cc1nc(C)c(CCC(O)=O)c(-c2ccc(C)cc2)c1CN
Show InChI InChI=1S/C21H28N2O2/c1-13(2)11-19-18(12-22)21(16-7-5-14(3)6-8-16)17(15(4)23-19)9-10-20(24)25/h5-8,13H,9-12,22H2,1-4H3,(H,24,25)
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n/an/a 1.10E+3n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of rat kidney DPP2 after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase II


(Rattus norvegicus)
BDBM50336817
PNG
(5-(Aminomethyl)-6-(2,2-dimethylpropyl)-4-(4-methyl...)
Show SMILES CC(C)Cc1nc(CC(C)(C)C)c(CN)c(-c2ccc(C)cc2)c1C(O)=O
Show InChI InChI=1S/C23H32N2O2/c1-14(2)11-18-21(22(26)27)20(16-9-7-15(3)8-10-16)17(13-24)19(25-18)12-23(4,5)6/h7-10,14H,11-13,24H2,1-6H3,(H,26,27)
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n/an/a 1.50E+3n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of rat kidney DPP2 after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase IX


(Homo sapiens (human))
BDBM50336815
PNG
(5-(Aminomethyl)-6-(2,2-dimethylpropyl)-4-(4-methyl...)
Show SMILES CCCc1nc(CC(C)(C)C)c(CN)c(-c2ccc(C)cc2)c1C(O)=O
Show InChI InChI=1S/C22H30N2O2/c1-6-7-17-20(21(25)26)19(15-10-8-14(2)9-11-15)16(13-23)18(24-17)12-22(3,4)5/h8-11H,6-7,12-13,23H2,1-5H3,(H,25,26)
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n/an/a 1.60E+3n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of FLAG-tagged human DPP9 expressed in human 293F cells after 90 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase II


(Rattus norvegicus)
BDBM50336816
PNG
(5-(Aminomethyl)-6-(2,2-dimethylpropyl)-2-(1-methyl...)
Show SMILES CC(C)c1nc(CC(C)(C)C)c(CN)c(-c2ccc(C)cc2)c1C(O)=O
Show InChI InChI=1S/C22H30N2O2/c1-13(2)20-19(21(25)26)18(15-9-7-14(3)8-10-15)16(12-23)17(24-20)11-22(4,5)6/h7-10,13H,11-12,23H2,1-6H3,(H,25,26)
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n/an/a 1.60E+3n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of rat kidney DPP2 after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase II


(Rattus norvegicus)
BDBM50336815
PNG
(5-(Aminomethyl)-6-(2,2-dimethylpropyl)-4-(4-methyl...)
Show SMILES CCCc1nc(CC(C)(C)C)c(CN)c(-c2ccc(C)cc2)c1C(O)=O
Show InChI InChI=1S/C22H30N2O2/c1-6-7-17-20(21(25)26)19(15-10-8-14(2)9-11-15)16(13-23)18(24-17)12-22(3,4)5/h8-11H,6-7,12-13,23H2,1-5H3,(H,25,26)
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n/an/a 2.00E+3n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of rat kidney DPP2 after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (human))
BDBM50336818
PNG
(5-(Aminomethyl)-2-benzyl-6-(2,2-dimethylpropyl)-4-...)
Show SMILES Cc1ccc(cc1)-c1c(CN)c(CC(C)(C)C)nc(Cc2ccccc2)c1C(O)=O
Show InChI InChI=1S/C26H30N2O2/c1-17-10-12-19(13-11-17)23-20(16-27)22(15-26(2,3)4)28-21(24(23)25(29)30)14-18-8-6-5-7-9-18/h5-13H,14-16,27H2,1-4H3,(H,29,30)
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n/an/a 2.00E+3n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of FLAG-tagged human DPP8 expressed in human 293F cells after 90 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (human))
BDBM50336816
PNG
(5-(Aminomethyl)-6-(2,2-dimethylpropyl)-2-(1-methyl...)
Show SMILES CC(C)c1nc(CC(C)(C)C)c(CN)c(-c2ccc(C)cc2)c1C(O)=O
Show InChI InChI=1S/C22H30N2O2/c1-13(2)20-19(21(25)26)18(15-9-7-14(3)8-10-15)16(12-23)17(24-20)11-22(4,5)6/h7-10,13H,11-12,23H2,1-6H3,(H,25,26)
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n/an/a 2.30E+3n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of FLAG-tagged human DPP8 expressed in human 293F cells after 90 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase IX


(Homo sapiens (human))
BDBM50336814
PNG
(5-(Aminomethyl)-6-(2,2-dimethylpropyl)-2-ethyl-4-(...)
Show SMILES CCc1nc(CC(C)(C)C)c(CN)c(-c2ccc(C)cc2)c1C(O)=O
Show InChI InChI=1S/C21H28N2O2/c1-6-16-19(20(24)25)18(14-9-7-13(2)8-10-14)15(12-22)17(23-16)11-21(3,4)5/h7-10H,6,11-12,22H2,1-5H3,(H,24,25)
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n/an/a 2.40E+3n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of FLAG-tagged human DPP9 expressed in human 293F cells after 90 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase IX


(Homo sapiens (human))
BDBM50336817
PNG
(5-(Aminomethyl)-6-(2,2-dimethylpropyl)-4-(4-methyl...)
Show SMILES CC(C)Cc1nc(CC(C)(C)C)c(CN)c(-c2ccc(C)cc2)c1C(O)=O
Show InChI InChI=1S/C23H32N2O2/c1-14(2)11-18-21(22(26)27)20(16-9-7-15(3)8-10-16)17(13-24)19(25-18)12-23(4,5)6/h7-10,14H,11-13,24H2,1-6H3,(H,26,27)
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n/an/a 3.00E+3n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of FLAG-tagged human DPP9 expressed in human 293F cells after 90 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase II


(Rattus norvegicus)
BDBM50336814
PNG
(5-(Aminomethyl)-6-(2,2-dimethylpropyl)-2-ethyl-4-(...)
Show SMILES CCc1nc(CC(C)(C)C)c(CN)c(-c2ccc(C)cc2)c1C(O)=O
Show InChI InChI=1S/C21H28N2O2/c1-6-16-19(20(24)25)18(14-9-7-13(2)8-10-14)15(12-22)17(23-16)11-21(3,4)5/h7-10H,6,11-12,22H2,1-5H3,(H,24,25)
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n/an/a 4.00E+3n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of rat kidney DPP2 after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase II


(Rattus norvegicus)
BDBM50333184
PNG
(5-(aminomethyl)-2-methyl-4-(4-methylphenyl)-6-(2-m...)
Show SMILES CC(C)Cc1nc(C)c(C(O)=O)c(-c2ccc(C)cc2)c1CN
Show InChI InChI=1S/C19H24N2O2/c1-11(2)9-16-15(10-20)18(14-7-5-12(3)6-8-14)17(19(22)23)13(4)21-16/h5-8,11H,9-10,20H2,1-4H3,(H,22,23)
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n/an/a 5.60E+3n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of rat kidney DPP2 after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase IX


(Homo sapiens (human))
BDBM50336818
PNG
(5-(Aminomethyl)-2-benzyl-6-(2,2-dimethylpropyl)-4-...)
Show SMILES Cc1ccc(cc1)-c1c(CN)c(CC(C)(C)C)nc(Cc2ccccc2)c1C(O)=O
Show InChI InChI=1S/C26H30N2O2/c1-17-10-12-19(13-11-17)23-20(16-27)22(15-26(2,3)4)28-21(24(23)25(29)30)14-18-8-6-5-7-9-18/h5-13H,14-16,27H2,1-4H3,(H,29,30)
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n/an/a 5.80E+3n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of FLAG-tagged human DPP9 expressed in human 293F cells after 90 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase II


(Rattus norvegicus)
BDBM50336813
PNG
(5-(Aminomethyl)-6-(2,2-dimethylpropyl)-2-methyl-4-...)
Show SMILES Cc1ccc(cc1)-c1c(CN)c(CC(C)(C)C)nc(C)c1C(O)=O
Show InChI InChI=1S/C20H26N2O2/c1-12-6-8-14(9-7-12)18-15(11-21)16(10-20(3,4)5)22-13(2)17(18)19(23)24/h6-9H,10-11,21H2,1-5H3,(H,23,24)
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n/an/a 1.00E+4n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of rat kidney DPP2 after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (human))
BDBM50333184
PNG
(5-(aminomethyl)-2-methyl-4-(4-methylphenyl)-6-(2-m...)
Show SMILES CC(C)Cc1nc(C)c(C(O)=O)c(-c2ccc(C)cc2)c1CN
Show InChI InChI=1S/C19H24N2O2/c1-11(2)9-16-15(10-20)18(14-7-5-12(3)6-8-14)17(19(22)23)13(4)21-16/h5-8,11H,9-10,20H2,1-4H3,(H,22,23)
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n/an/a 1.10E+4n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of FLAG-tagged human DPP8 expressed in human 293F cells after 90 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase II


(Rattus norvegicus)
BDBM50336812
PNG
(5-(Aminomethyl)-6-butyl-2-methyl-4-(4-methylphenyl...)
Show SMILES CCCCc1nc(C)c(C(O)=O)c(-c2ccc(C)cc2)c1CN
Show InChI InChI=1S/C19H24N2O2/c1-4-5-6-16-15(11-20)18(14-9-7-12(2)8-10-14)17(19(22)23)13(3)21-16/h7-10H,4-6,11,20H2,1-3H3,(H,22,23)
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n/an/a 1.10E+4n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of rat kidney DPP2 after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase IX


(Homo sapiens (human))
BDBM50336816
PNG
(5-(Aminomethyl)-6-(2,2-dimethylpropyl)-2-(1-methyl...)
Show SMILES CC(C)c1nc(CC(C)(C)C)c(CN)c(-c2ccc(C)cc2)c1C(O)=O
Show InChI InChI=1S/C22H30N2O2/c1-13(2)20-19(21(25)26)18(15-9-7-14(3)8-10-15)16(12-23)17(24-20)11-22(4,5)6/h7-10,13H,11-12,23H2,1-6H3,(H,25,26)
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n/an/a 1.10E+4n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of FLAG-tagged human DPP9 expressed in human 293F cells after 90 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase IX


(Homo sapiens (human))
BDBM50336813
PNG
(5-(Aminomethyl)-6-(2,2-dimethylpropyl)-2-methyl-4-...)
Show SMILES Cc1ccc(cc1)-c1c(CN)c(CC(C)(C)C)nc(C)c1C(O)=O
Show InChI InChI=1S/C20H26N2O2/c1-12-6-8-14(9-7-12)18-15(11-21)16(10-20(3,4)5)22-13(2)17(18)19(23)24/h6-9H,10-11,21H2,1-5H3,(H,23,24)
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n/an/a 1.20E+4n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of FLAG-tagged human DPP9 expressed in human 293F cells after 90 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (human))
BDBM50336813
PNG
(5-(Aminomethyl)-6-(2,2-dimethylpropyl)-2-methyl-4-...)
Show SMILES Cc1ccc(cc1)-c1c(CN)c(CC(C)(C)C)nc(C)c1C(O)=O
Show InChI InChI=1S/C20H26N2O2/c1-12-6-8-14(9-7-12)18-15(11-21)16(10-20(3,4)5)22-13(2)17(18)19(23)24/h6-9H,10-11,21H2,1-5H3,(H,23,24)
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n/an/a 1.20E+4n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of FLAG-tagged human DPP8 expressed in human 293F cells after 90 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (human))
BDBM50336809
PNG
(3-[5-(Aminomethyl)-2-methyl-4-(4-methylphenyl)-6-(...)
Show SMILES CC(C)Cc1nc(C)c(CCC(O)=O)c(-c2ccc(C)cc2)c1CN
Show InChI InChI=1S/C21H28N2O2/c1-13(2)11-19-18(12-22)21(16-7-5-14(3)6-8-16)17(15(4)23-19)9-10-20(24)25/h5-8,13H,9-12,22H2,1-4H3,(H,24,25)
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n/an/a>3.00E+4n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of FLAG-tagged human DPP8 expressed in human 293F cells after 90 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase IX


(Homo sapiens (human))
BDBM50336808
PNG
(CHEMBL1672115 | [5-(Aminomethyl)-2-methyl-4-(4-met...)
Show SMILES CC(C)Cc1nc(C)c(CC(O)=O)c(-c2ccc(C)cc2)c1CN
Show InChI InChI=1S/C20H26N2O2/c1-12(2)9-18-17(11-21)20(15-7-5-13(3)6-8-15)16(10-19(23)24)14(4)22-18/h5-8,12H,9-11,21H2,1-4H3,(H,23,24)
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n/an/a>3.00E+4n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of FLAG-tagged human DPP9 expressed in human 293F cells after 90 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (human))
BDBM50336808
PNG
(CHEMBL1672115 | [5-(Aminomethyl)-2-methyl-4-(4-met...)
Show SMILES CC(C)Cc1nc(C)c(CC(O)=O)c(-c2ccc(C)cc2)c1CN
Show InChI InChI=1S/C20H26N2O2/c1-12(2)9-18-17(11-21)20(15-7-5-13(3)6-8-15)16(10-19(23)24)14(4)22-18/h5-8,12H,9-11,21H2,1-4H3,(H,23,24)
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n/an/a>3.00E+4n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of FLAG-tagged human DPP8 expressed in human 293F cells after 90 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase IX


(Homo sapiens (human))
BDBM50336809
PNG
(3-[5-(Aminomethyl)-2-methyl-4-(4-methylphenyl)-6-(...)
Show SMILES CC(C)Cc1nc(C)c(CCC(O)=O)c(-c2ccc(C)cc2)c1CN
Show InChI InChI=1S/C21H28N2O2/c1-13(2)11-19-18(12-22)21(16-7-5-14(3)6-8-16)17(15(4)23-19)9-10-20(24)25/h5-8,13H,9-12,22H2,1-4H3,(H,24,25)
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n/an/a>3.00E+4n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of FLAG-tagged human DPP9 expressed in human 293F cells after 90 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase IX


(Homo sapiens (human))
BDBM50333184
PNG
(5-(aminomethyl)-2-methyl-4-(4-methylphenyl)-6-(2-m...)
Show SMILES CC(C)Cc1nc(C)c(C(O)=O)c(-c2ccc(C)cc2)c1CN
Show InChI InChI=1S/C19H24N2O2/c1-11(2)9-16-15(10-20)18(14-7-5-12(3)6-8-14)17(19(22)23)13(4)21-16/h5-8,11H,9-10,20H2,1-4H3,(H,22,23)
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n/an/a 3.00E+4n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of FLAG-tagged human DPP9 expressed in human 293F cells after 90 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase II


(Rattus norvegicus)
BDBM50336808
PNG
(CHEMBL1672115 | [5-(Aminomethyl)-2-methyl-4-(4-met...)
Show SMILES CC(C)Cc1nc(C)c(CC(O)=O)c(-c2ccc(C)cc2)c1CN
Show InChI InChI=1S/C20H26N2O2/c1-12(2)9-18-17(11-21)20(15-7-5-13(3)6-8-15)16(10-19(23)24)14(4)22-18/h5-8,12H,9-11,21H2,1-4H3,(H,23,24)
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n/an/a 5.00E+4n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of rat kidney DPP2 after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase IX


(Homo sapiens (human))
BDBM50336820
PNG
(CHEMBL1672127 | [5-(Aminomethyl)-6-(2,2-dimethylpr...)
Show SMILES CCc1nc(CC(C)(C)C)c(CN)c(-c2ccc(C)cc2)c1CC(O)=O
Show InChI InChI=1S/C22H30N2O2/c1-6-18-16(11-20(25)26)21(15-9-7-14(2)8-10-15)17(13-23)19(24-18)12-22(3,4)5/h7-10H,6,11-13,23H2,1-5H3,(H,25,26)
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n/an/a 6.00E+4n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of FLAG-tagged human DPP9 expressed in human 293F cells after 90 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (human))
BDBM50336820
PNG
(CHEMBL1672127 | [5-(Aminomethyl)-6-(2,2-dimethylpr...)
Show SMILES CCc1nc(CC(C)(C)C)c(CN)c(-c2ccc(C)cc2)c1CC(O)=O
Show InChI InChI=1S/C22H30N2O2/c1-6-18-16(11-20(25)26)21(15-9-7-14(2)8-10-15)17(13-23)19(24-18)12-22(3,4)5/h7-10H,6,11-13,23H2,1-5H3,(H,25,26)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of FLAG-tagged human DPP8 expressed in human 293F cells after 90 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase II


(Rattus norvegicus)
BDBM50336820
PNG
(CHEMBL1672127 | [5-(Aminomethyl)-6-(2,2-dimethylpr...)
Show SMILES CCc1nc(CC(C)(C)C)c(CN)c(-c2ccc(C)cc2)c1CC(O)=O
Show InChI InChI=1S/C22H30N2O2/c1-6-18-16(11-20(25)26)21(15-9-7-14(2)8-10-15)17(13-23)19(24-18)12-22(3,4)5/h7-10H,6,11-13,23H2,1-5H3,(H,25,26)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of rat kidney DPP2 after 60 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (human))
BDBM50336819
PNG
(CHEMBL1672126 | [5-(Aminomethyl)-6-(2,2-dimethylpr...)
Show SMILES Cc1ccc(cc1)-c1c(CN)c(CC(C)(C)C)nc(C)c1CC(O)=O
Show InChI InChI=1S/C21H28N2O2/c1-13-6-8-15(9-7-13)20-16(10-19(24)25)14(2)23-18(17(20)12-22)11-21(3,4)5/h6-9H,10-12,22H2,1-5H3,(H,24,25)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of FLAG-tagged human DPP8 expressed in human 293F cells after 90 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
Dipeptidyl peptidase IX


(Homo sapiens (human))
BDBM50336819
PNG
(CHEMBL1672126 | [5-(Aminomethyl)-6-(2,2-dimethylpr...)
Show SMILES Cc1ccc(cc1)-c1c(CN)c(CC(C)(C)C)nc(C)c1CC(O)=O
Show InChI InChI=1S/C21H28N2O2/c1-13-6-8-15(9-7-13)20-16(10-19(24)25)14(2)23-18(17(20)12-22)11-21(3,4)5/h6-9H,10-12,22H2,1-5H3,(H,24,25)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Inhibition of FLAG-tagged human DPP9 expressed in human 293F cells after 90 mins


J Med Chem 54: 831-50 (2012)


Article DOI: 10.1021/jm101236h
BindingDB Entry DOI: 10.7270/Q2QR4Z4M
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%