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Compile Data Set for Download or QSAR
maximum 50k data
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
(change energy unit to
kcal/mol
)
Found
48
hits in this display
Target
Dipeptidyl peptidase 4
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: 0.100nM
Assay Description:
Inhibition of human DPP4 preincubated for 30 mins followed by Gly-Pro-AMC addition measured for 50 mins by continuous fluorescence assay
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Target
Dipeptidyl peptidase 4
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 0.100nM
Assay Description:
Inhibition of human C-terminal step-tagged DPP4 expressed using baculovirus system
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Target
Dipeptidyl peptidase 4
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
Copy SMILES
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Affinity Data
IC50: 0.210nM
Assay Description:
DPP-IV could hydrolyze Gly-Pro-Aminoluciferin at room temperature to generate Aminoluciferin, which could produce “glow type” luminescent signals in ...
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Target
Dipeptidyl peptidase 4
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
Copy SMILES
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Affinity Data
IC50: 0.320nM
Assay Description:
The synthetic title compounds 7 (a-j) and 8 (a-j) were screened for in vitro DPP-4 inhibition using DPP-4 activity assay kit (Krishgen BioSystems). D...
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Target
Dipeptidyl peptidase 4
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 0.400nM
Assay Description:
Inhibition of human DPP4 using Gly-Pro-AMC as substrate incubated for 30 mins by continuous fluorescent assay
More data for this Ligand-Target Pair
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Target
Dipeptidyl peptidase 4
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 1nM
pH: 7.8
Assay Description:
50 μl substrate solution (AFC; AFC is amido-4-trifluoromethylcoumarin), final concentration 100 μM, were placed in black microtitre plates. 20 ...
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Target
Dipeptidyl peptidase 4 [K6R,T557I]
(Homo sapiens (Human))
China Pharmaceutical University
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: 1nM
Assay Description:
The DPP-4 Drug Discovery Kit (Enzo Life Sciences International, Inc.) was used for the assay of inhibition of DPP-4 activity. The assay is based on t...
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Target
Dipeptidyl peptidase 4
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: 1nM
T: 2°C
Assay Description:
Gly-Pro-7-amido-4-methylcoumarin can be hydrolyzed by dipeptidyl peptidase IV (DPP-IV) at room temperature, to generate 7-amido-4-methyl coumarin, wh...
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Target
Dipeptidyl peptidase 4
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 1nM
Assay Description:
Inhibition of DPP4 (unknown origin)
More data for this Ligand-Target Pair
Target Info
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Target
Dipeptidyl peptidase 4
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 1nM
Assay Description:
Inhibition of human recombinant DPP4 (39 to 766 residues) using Ala-Pro-AFC as substrate incubated for 1 hr by fluorescence assay
More data for this Ligand-Target Pair
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Target
Dipeptidyl peptidase 4
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 1nM
Assay Description:
Inhibition of dipeptidyl peptidase 4 (unknown origin)
More data for this Ligand-Target Pair
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Target
Dipeptidyl peptidase 4
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 1nM
Assay Description:
50 μl substrate solution (AFC; AFC is amido-4-trifluoromethylcoumarin), final concentration 100 μM, were placed in black microtitre plates....
More data for this Ligand-Target Pair
Target Info
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Target
Dipeptidyl peptidase 4
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 1nM
pH: 7.8
Assay Description:
50 μl substrate solution (AFC; AFC is amido-4-trifluoromethylcoumarin), final concentration 100 μM, were placed in black microtitre plates....
More data for this Ligand-Target Pair
Target Info
PDB
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KEGG
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Copy BDB DOI
Target
Dipeptidyl peptidase 4
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 1nM
Assay Description:
Inhibition of DPP4 in human plasma using Gly-Pro-AMC as substrate by fluorimetric analysis
More data for this Ligand-Target Pair
Target Info
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Target
Dipeptidyl peptidase 4
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 1nM
Assay Description:
Inhibition of DPP4 in human Caco-2 cells after 1 hr
More data for this Ligand-Target Pair
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Target
Dipeptidyl peptidase 4
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 1nM
Assay Description:
Inhibition of human DPP4 in Caco2 cells by fluorescene assay
More data for this Ligand-Target Pair
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Target
Dipeptidyl peptidase 4
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
Copy SMILES
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Affinity Data
IC50: 1.30nM
Assay Description:
Inhibition of human recombinant DPP-4 using (H-Gly-Pro-AMC as substrate
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Target
Dipeptidyl peptidase 4
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 1.30nM
Assay Description:
Inhibition of human DPP4 in pH 7.4 Tris buffer using AP-7-ATFMC as substrate preincubated for 15 mins followed by substrate addition by microplate re...
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Target
Dipeptidyl peptidase 4
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 2nM
Assay Description:
Inhibition of human DPP4
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Target
Dipeptidyl peptidase 4
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 2nM
Assay Description:
Inhibition of DPP4 purified from human seminal plasma using Gly-Pro-p-nitroanilide as substrate by spectrophotometry
More data for this Ligand-Target Pair
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Target
Acyl-protein thioesterase 1
(Rattus norvegicus)
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: 71nM
Assay Description:
Inhibition of FAP (unknown origin) preincubated for 20 mins followed by Nle-Pro-AMC addition measured for 40 mins by continuous fluorescence assay
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Target
Prolyl endopeptidase FAP
(Homo sapiens (Human))
Dainippon Sumitomo Pharma
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: 89nM
Assay Description:
Inhibition of FAPalpha
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Target
Muscarinic acetylcholine receptor M1
(Homo sapiens (Human))
Argenta Discovery
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: 295nM
Assay Description:
Inhibition of M1 receptor
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Target
Muscarinic acetylcholine receptor M1
(Homo sapiens (Human))
Argenta Discovery
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: 295nM
Assay Description:
Displacement of [N-methyl-3H]-scopolamine from human recombinant muscarinic M1 receptor expressed in CHO cells
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Target
Muscarinic acetylcholine receptor M1
(Homo sapiens (Human))
Argenta Discovery
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: 300nM
Assay Description:
Inhibition of M1 receptor (unknown origin)
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Target
Prolyl endopeptidase FAP
(Mus musculus (Mouse))
University Of Antwerp (Ua)
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: 370nM
Assay Description:
Inhibition of mouse recombinant FAP expressed in HEK293 cells using Ala-Pro-p-nitroanilide as substrate incubated for 15 mins prior to substrate addi...
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Target
Prolyl endopeptidase FAP
(Mus musculus (Mouse))
University Of Antwerp (Ua)
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: 370nM
Assay Description:
Inhibition of recombinant mouse FAP purified from HEK293 cell supernatant using Ala-Pro-p-nitroanilide as substrate by spectrophotometry
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Target
Dipeptidyl peptidase IV
(Porphyromonas gingivalis)
University Of Warwick
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: 1.00E+4nM
Assay Description:
Inhibition of Porphyromonas gingivalis N-terminal His-tagged DPP4 expressed in Escherichia coli using Gly-Pro-p-nitroanilide as substrate
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Dipeptidyl peptidase 9
(Homo sapiens (Human))
Dainippon Sumitomo Pharma
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: >1.00E+4nM
Assay Description:
Inhibition of DPP9
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Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human))
Argenta Discovery
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: >3.00E+4nM
Assay Description:
Inhibition of human ERG by dofetilide binding assay
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Dipeptidyl peptidase 8
(Homo sapiens (Human))
Dainippon Sumitomo Pharma
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: >4.00E+4nM
Assay Description:
Inhibition of DPP8
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POU domain, class 2, transcription factor 1
(Homo sapiens (Human))
Nippon Boehringer Ingelheim
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: 4.10E+4nM
Assay Description:
Inhibition of OCT1 (unknown origin) expressed in HEK293 cells assessed as reduction of [14C]metformin substrate uptake at 100 uM by liquid scintillat...
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POU domain, class 2, transcription factor 1
(Homo sapiens (Human))
Nippon Boehringer Ingelheim
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: 4.50E+4nM
Assay Description:
Inhibition of OCT1 (unknown origin) expressed in HEK293 cells assessed as reduction of [ethyl 1-14C]TEA substrate uptake at 100 uM by liquid scintill...
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POU domain, class 2, transcription factor 2
(Homo sapiens (Human))
Nippon Boehringer Ingelheim
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: 8.00E+4nM
Assay Description:
Inhibition of OCT2 (unknown origin) expressed in HEK293 cells assessed as reduction of [14C]metformin substrate uptake at 100 uM by liquid scintillat...
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Dipeptidyl peptidase 9
(Homo sapiens (Human))
Dainippon Sumitomo Pharma
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: >1.00E+5nM
Assay Description:
Inhibition of DPP9 (unknown origin) preincubated for 20 mins followed by Gly-Pro-AMC addition measured for 50 mins by continuous fluorescence assay
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Prolyl endopeptidase
(Homo sapiens (Human))
University Of Antwerp
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: >1.00E+5nM
Assay Description:
Inhibition of recombinant human PREP purified from Escherichia coli using Z-Gly-Pro-p-nitroanilide as substrate by spectrophotometry
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Dipeptidyl peptidase 2
(Homo sapiens (Human))
University Of Warwick
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: >1.00E+5nM
Assay Description:
Inhibition of DPP2 (unknown origin)
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Dipeptidyl peptidase 8
(Homo sapiens (Human))
Dainippon Sumitomo Pharma
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: >1.00E+5nM
Assay Description:
Inhibition of DPP8 (unknown origin)
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Dipeptidyl peptidase 9
(Bos taurus)
University Of Warwick
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: >1.00E+5nM
Assay Description:
Inhibition of bovine DPP9
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Dipeptidyl peptidase 2
(Homo sapiens (Human))
University Of Warwick
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: >1.00E+5nM
Assay Description:
Inhibition of human DPP2 using Lys-Ala-AMC as substrate by fluorimetric analysis
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Prolyl endopeptidase
(Homo sapiens (Human))
University Of Antwerp
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: >1.00E+5nM
Assay Description:
Inhibition of human recombinant PREP expressed in Escherichia coli using Z-Gly-Pro-p-nitroanilide as substrate incubated for 15 mins prior to substra...
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Target
Dipeptidyl peptidase 2
(Homo sapiens (Human))
University Of Warwick
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: >1.00E+5nM
Assay Description:
Inhibition of DPP2 purified from human seminal plasma using Lys-Ala-p-nitroanilide as substrate by spectrophotometry
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Dipeptidyl peptidase 8
(Homo sapiens (Human))
Dainippon Sumitomo Pharma
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: >1.00E+5nM
Assay Description:
Inhibition of recombinant DPP8 (unknown origin) preincubated for 20 mins followed by Ala-Pro-AFC addition measured for 40 mins by continuous fluoresc...
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Target
Dipeptidyl peptidase 2
(Homo sapiens (Human))
University Of Warwick
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: >1.00E+5nM
Assay Description:
Inhibition of QPP (unknown origin) preincubated for 30 mins followed by Nle-Pro-AMC addition measured for 50 mins by continuous fluorescence assay
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Solute carrier family 22 member 8
(Homo sapiens (Human))
Nippon Boehringer Ingelheim
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: >1.00E+5nM
Assay Description:
Inhibition of OAT3 (unknown origin) expressed in HEK293 cells assessed as reduction of [3H]E-sul substrate uptake by liquid scintillation counting
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Solute carrier organic anion transporter family member 1B1
(Homo sapiens (Human))
Nippon Boehringer Ingelheim
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
IC50: >1.00E+5nM
Assay Description:
Inhibition of OATP1B1 (unknown origin) expressed in HEK293 cells assessed as reduction of [3H]E217betaG substrate uptake by liquid scintillation coun...
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Dipeptidyl peptidase 4
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
Kd: 0.00660nM
Assay Description:
Binding affinity to human recombinant DPP4 (39 to 766 residues) by surface plasmon resonance analysis
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Target
Dipeptidyl peptidase 4
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50228403
((R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-met...)
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Affinity Data
Kd: 5.30nM
Assay Description:
Binding affinity to human recombinant DPP4 (39 to 766 residues) at 5 uM by isothermal titration calorimetry
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