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SMILES: Cl.[H][C@]12CCc3nnc(C(C)C)n3[C@]1([H])CCN(C2)C(=O)C[C@H](N)Cc1cc(F)c(F)cc1F

InChI Key: InChIKey=SWWGVDAQPQANAI-NFOYORQJSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50267158   
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))		BDBM50267158
PNG
(CHEMBL4098632)
Show SMILES Cl.[H][C@]12CCc3nnc(C(C)C)n3[C@]1([H])CCN(C2)C(=O)C[C@H](N)Cc1cc(F)c(F)cc1F |r|
Show InChI InChI=1S/C22H28F3N5O.ClH/c1-12(2)22-28-27-20-4-3-13-11-29(6-5-19(13)30(20)22)21(31)9-15(26)7-14-8-17(24)18(25)10-16(14)23;/h8,10,12-13,15,19H,3-7,9,11,26H2,1-2H3;1H/t13-,15-,19-;/m1./s1
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Article
PubMed
n/an/a 152n/an/an/an/an/an/a



University Park Nottingham

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DPP-4 expressed in HEK293 cells using H-Gly-Pro-AMC as substrate measured over 15 mins by fluorescence analysis

J Med Chem 60: 1534-1554 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01801
BindingDB Entry DOI: 10.7270/Q2251MPR
More data for this
Ligand-Target Pair