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SMILES: COc1ccc(CCNCC(=O)N2C[C@@H](F)C[C@H]2C#N)cc1OC

InChI Key: InChIKey=DOUNOGSCSVQUSN-KBPBESRZSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50242494   
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))		BDBM50242494
PNG
((2S,4S)-1-{N-[2-(3,4-Dimethoxyphenyl)ethyl]glycyl}...)
Show SMILES COc1ccc(CCNCC(=O)N2C[C@@H](F)C[C@H]2C#N)cc1OC |r|
Show InChI InChI=1S/C17H22FN3O3/c1-23-15-4-3-12(7-16(15)24-2)5-6-20-10-17(22)21-11-13(18)8-14(21)9-19/h3-4,7,13-14,20H,5-6,8,10-11H2,1-2H3/t13-,14-/m0/s1
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n/an/a 27n/an/an/an/an/an/a



Taisho Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of DPP4 in human plasma by fluorescence assay

Bioorg Med Chem 16: 4093-106 (2008)


Article DOI: 10.1016/j.bmc.2008.01.016
BindingDB Entry DOI: 10.7270/Q27H1KGN
More data for this
Ligand-Target Pair