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PubMed code 15357972

Compile data set for download or QSAR
Found 30 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Dipeptidyl peptidase IV


(Rattus norvegicus (rat))
BDBM50150870
PNG
(6-{2-[2-((S)-5-Cyano-pyrazolidin-1-yl)-2-oxo-ethyl...)
Show SMILES O=C(CNCCNc1ccc(cn1)C#N)N1NCC[C@H]1C#N
Show InChI InChI=1S/C14H17N7O/c15-7-11-1-2-13(19-9-11)18-6-5-17-10-14(22)21-12(8-16)3-4-20-21/h1-2,9,12,17,20H,3-6,10H2,(H,18,19)/t12-/m0/s1
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n/an/a 60n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat dipeptidyl peptidase IV


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 (DPP4)


(Homo sapiens (human))
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
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 80n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory concentration against dipeptidyl peptidase IV in Caco-2 cell assay


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 IV


(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
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 (DPP4)


(Homo sapiens (human))
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
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 200n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory concentration against dipeptidyl peptidase IV in Caco-2 cell assay


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 IV


(Rattus norvegicus (rat))
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
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 220n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat dipeptidyl peptidase IV


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 IV


(Rattus norvegicus (rat))
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
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 360n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat dipeptidyl peptidase IV


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 (DPP4)


(Homo sapiens (human))
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
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 410n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory concentration against dipeptidyl peptidase IV in Caco-2 cell assay


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 IV


(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
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 IV


(Rattus norvegicus (rat))
BDBM50150860
PNG
(CHEMBL361656 | [(S)-5-Amino-1-(5-cyano-4,5-dihydro...)
Show SMILES NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1N=CCC1C#N
Show InChI InChI=1S/C18H23N5O3/c19-10-5-4-8-16(17(24)23-15(12-20)9-11-21-23)22-18(25)26-13-14-6-2-1-3-7-14/h1-3,6-7,11,15-16H,4-5,8-10,13,19H2,(H,22,25)/t15?,16-/m0/s1
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n/an/a 660n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat dipeptidyl peptidase IV


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 IV


(Rattus norvegicus (rat))
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
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 800n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat dipeptidyl peptidase IV


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 IV


(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
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 960n/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 IV


(Rattus norvegicus (rat))
BDBM50150866
PNG
(2-{2-[4-(5-Nitro-pyridin-2-ylamino)-cyclohexylamin...)
Show SMILES [O-][N+](=O)c1ccc(NC2CCC(CC2)NCC(=O)N2N=CCC2C#N)nc1
Show InChI InChI=1S/C17H21N7O3/c18-9-14-7-8-21-23(14)17(25)11-19-12-1-3-13(4-2-12)22-16-6-5-15(10-20-16)24(26)27/h5-6,8,10,12-14,19H,1-4,7,11H2,(H,20,22)
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n/an/a 1.20E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat dipeptidyl peptidase IV


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 IV


(Rattus norvegicus (rat))
BDBM50150862
PNG
(2-((R)-2-Amino-propionyl)-3,4-dihydro-2H-pyrazole-...)
Show SMILES C[C@@H](N)C(=O)N1N=CCC1C#N
Show InChI InChI=1S/C7H10N4O/c1-5(9)7(12)11-6(4-8)2-3-10-11/h3,5-6H,2,9H2,1H3/t5-,6?/m1/s1
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n/an/a 1.20E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat dipeptidyl peptidase IV


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 IV


(Rattus norvegicus (rat))
BDBM50150865
PNG
(2-{2-[2-(5-Nitro-pyridin-2-ylamino)-ethylamino]-ac...)
Show SMILES [O-][N+](=O)c1ccc(NCCNCC(=O)N2N=CCC2C#N)nc1
Show InChI InChI=1S/C13H15N7O3/c14-7-10-3-4-18-19(10)13(21)9-15-5-6-16-12-2-1-11(8-17-12)20(22)23/h1-2,4,8,10,15H,3,5-6,9H2,(H,16,17)
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n/an/a 1.20E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat dipeptidyl peptidase IV


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 IV


(Rattus norvegicus (rat))
BDBM50150856
PNG
(2-(2-Cyclopentylamino-acetyl)-3,4-dihydro-2H-pyraz...)
Show SMILES O=C(CNC1CCCC1)N1N=CCC1C#N
Show InChI InChI=1S/C11H16N4O/c12-7-10-5-6-14-15(10)11(16)8-13-9-3-1-2-4-9/h6,9-10,13H,1-5,8H2
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n/an/a 1.30E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat dipeptidyl peptidase IV


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 IV


(Rattus norvegicus (rat))
BDBM50150869
PNG
(2-[2-(Adamantan-1-ylamino)-acetyl]-3,4-dihydro-2H-...)
Show SMILES O=C(CNC12CC3CC(CC(C3)C1)C2)N1N=CCC1C#N
Show InChI InChI=1S/C16H22N4O/c17-9-14-1-2-19-20(14)15(21)10-18-16-6-11-3-12(7-16)5-13(4-11)8-16/h2,11-14,18H,1,3-8,10H2
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n/an/a 1.50E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat dipeptidyl peptidase IV


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 IV


(Rattus norvegicus (rat))
BDBM50150867
PNG
(2-((R)-2-Amino-3-methyl-butyryl)-3,4-dihydro-2H-py...)
Show SMILES CC(C)[C@@H](N)C(=O)N1N=CCC1C#N
Show InChI InChI=1S/C9H14N4O/c1-6(2)8(11)9(14)13-7(5-10)3-4-12-13/h4,6-8H,3,11H2,1-2H3/t7?,8-/m1/s1
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n/an/a 1.90E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat dipeptidyl peptidase IV


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 IV


(Rattus norvegicus (rat))
BDBM50150853
PNG
(2-(2-tert-Butylamino-acetyl)-3,4-dihydro-2H-pyrazo...)
Show SMILES CC(C)(C)NCC(=O)N1N=CCC1C#N
Show InChI InChI=1S/C10H16N4O/c1-10(2,3)12-7-9(15)14-8(6-11)4-5-13-14/h5,8,12H,4,7H2,1-3H3
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n/an/a 2.10E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat dipeptidyl peptidase IV


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 IV


(Rattus norvegicus (rat))
BDBM50150859
PNG
(2-[2-(Bicyclo[2.2.1]hept-2-ylamino)-acetyl]-3,4-di...)
Show SMILES O=C(CNC1CC2CCC1C2)N1N=CCC1C#N
Show InChI InChI=1S/C13H18N4O/c14-7-11-3-4-16-17(11)13(18)8-15-12-6-9-1-2-10(12)5-9/h4,9-12,15H,1-3,5-6,8H2
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n/an/a 2.10E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat dipeptidyl peptidase IV


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 IV


(Rattus norvegicus (rat))
BDBM50150868
PNG
(2-(2-Cyclohexylamino-acetyl)-3,4-dihydro-2H-pyrazo...)
Show SMILES O=C(CNC1CCCCC1)N1N=CCC1C#N
Show InChI InChI=1S/C12H18N4O/c13-8-11-6-7-15-16(11)12(17)9-14-10-4-2-1-3-5-10/h7,10-11,14H,1-6,9H2
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n/an/a 2.30E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat dipeptidyl peptidase IV


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 IV


(Rattus norvegicus (rat))
BDBM50150855
PNG
(2-(2-Cyclooctylamino-acetyl)-3,4-dihydro-2H-pyrazo...)
Show SMILES O=C(CNC1CCCCCCC1)N1N=CCC1C#N
Show InChI InChI=1S/C14H22N4O/c15-10-13-8-9-17-18(13)14(19)11-16-12-6-4-2-1-3-5-7-12/h9,12-13,16H,1-8,11H2
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n/an/a 2.60E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat dipeptidyl peptidase IV


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 (DPP4)


(Homo sapiens (human))
BDBM50150857
PNG
(6-{2-[2-((R)-5-Cyano-4,5-dihydro-pyrazol-1-yl)-2-o...)
Show SMILES O=C(CNCCNc1ccc(cn1)C#N)N1N=CC[C@@H]1C#N
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-/m1/s1
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n/an/a 2.62E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory concentration against dipeptidyl peptidase IV in Caco-2 cell assay


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 IV


(Rattus norvegicus (rat))
BDBM50150868
PNG
(2-(2-Cyclohexylamino-acetyl)-3,4-dihydro-2H-pyrazo...)
Show SMILES O=C(CNC1CCCCC1)N1N=CCC1C#N
Show InChI InChI=1S/C12H18N4O/c13-8-11-6-7-15-16(11)12(17)9-14-10-4-2-1-3-5-10/h7,10-11,14H,1-6,9H2
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n/an/a 2.80E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat dipeptidyl peptidase IV


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 IV


(Rattus norvegicus (rat))
BDBM50150861
PNG
(2-[2-(Adamantan-2-ylamino)-acetyl]-3,4-dihydro-2H-...)
Show SMILES O=C(CNC1C2CC3CC(C2)CC1C3)N1N=CCC1C#N
Show InChI InChI=1S/C16H22N4O/c17-8-14-1-2-19-20(14)15(21)9-18-16-12-4-10-3-11(6-12)7-13(16)5-10/h2,10-14,16,18H,1,3-7,9H2
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n/an/a 3.20E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat dipeptidyl peptidase IV


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 IV


(Rattus norvegicus (rat))
BDBM50150863
PNG
(2-((S)-2-Amino-4-methyl-pentanoyl)-3,4-dihydro-2H-...)
Show SMILES CC(C)C[C@H](N)C(=O)N1N=CCC1C#N
Show InChI InChI=1S/C10H16N4O/c1-7(2)5-9(12)10(15)14-8(6-11)3-4-13-14/h4,7-9H,3,5,12H2,1-2H3/t8?,9-/m0/s1
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n/an/a 4.30E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat dipeptidyl peptidase IV


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 IV


(Rattus norvegicus (rat))
BDBM50150852
PNG
(CHEMBL362297 | N-{4-[2-(5-Cyano-4,5-dihydro-pyrazo...)
Show SMILES O=C(CNC1CCC(CC1)NC(=O)c1ccccc1)N1N=CCC1C#N
Show InChI InChI=1S/C19H23N5O2/c20-12-17-10-11-22-24(17)18(25)13-21-15-6-8-16(9-7-15)23-19(26)14-4-2-1-3-5-14/h1-5,11,15-17,21H,6-10,13H2,(H,23,26)
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n/an/a 4.40E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat dipeptidyl peptidase IV


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 IV


(Rattus norvegicus (rat))
BDBM50150857
PNG
(6-{2-[2-((R)-5-Cyano-4,5-dihydro-pyrazol-1-yl)-2-o...)
Show SMILES O=C(CNCCNc1ccc(cn1)C#N)N1N=CC[C@@H]1C#N
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-/m1/s1
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n/an/a 5.20E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat dipeptidyl peptidase IV


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 IV


(Rattus norvegicus (rat))
BDBM50150864
PNG
(2-[2-(3-Hydroxy-adamantan-1-ylamino)-acetyl]-3,4-d...)
Show SMILES OC12CC3CC(C1)CC(C3)(C2)NCC(=O)N1N=CCC1C#N
Show InChI InChI=1S/C16H22N4O2/c17-8-13-1-2-19-20(13)14(21)9-18-15-4-11-3-12(5-15)7-16(22,6-11)10-15/h2,11-13,18,22H,1,3-7,9-10H2
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n/an/a 6.40E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat dipeptidyl peptidase IV


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 IV


(Sus scrofa (pig))
BDBM50150857
PNG
(6-{2-[2-((R)-5-Cyano-4,5-dihydro-pyrazol-1-yl)-2-o...)
Show SMILES O=C(CNCCNc1ccc(cn1)C#N)N1N=CC[C@@H]1C#N
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-/m1/s1
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n/an/a 6.82E+3n/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 IV


(Rattus norvegicus (rat))
BDBM50150853
PNG
(2-(2-tert-Butylamino-acetyl)-3,4-dihydro-2H-pyrazo...)
Show SMILES CC(C)(C)NCC(=O)N1N=CCC1C#N
Show InChI InChI=1S/C10H16N4O/c1-10(2,3)12-7-9(15)14-8(6-11)4-5-13-14/h5,8,12H,4,7H2,1-3H3
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n/an/a 2.44E+4n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat dipeptidyl peptidase IV


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
* indicates data uncertainty>20%