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BDBM50134191 CHEMBL3734769

SMILES: CS(=O)(=O)Nc1n[nH]c2CN(Cc12)[C@H]1CO[C@@H]([C@@H](N)C1)c1cc(F)ccc1F

InChI Key: InChIKey=CJFIHMQQAXBOQU-FUEDEBDSSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50134191   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Dipeptidyl peptidase 4


(Homo sapiens (Human))		BDBM50134191
PNG
(CHEMBL3734769)
Show SMILES CS(=O)(=O)Nc1n[nH]c2CN(Cc12)[C@H]1CO[C@@H]([C@@H](N)C1)c1cc(F)ccc1F |r|
Show InChI InChI=1S/C17H21F2N5O3S/c1-28(25,26)23-17-12-6-24(7-15(12)21-22-17)10-5-14(20)16(27-8-10)11-4-9(18)2-3-13(11)19/h2-4,10,14,16H,5-8,20H2,1H3,(H2,21,22,23)/t10-,14+,16-/m1/s1
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PubMed
n/an/a 3.20n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DPP4 expressed in Sf9 cells using Gly-Pro-AMC substrate after 30 mins by plate reader analysis

Bioorg Med Chem Lett 25: 5767-71 (2015)


BindingDB Entry DOI: 10.7270/Q208675S
More data for this
Ligand-Target Pair