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SMILES: CC#CCn1c(nc2ccn(Cc3c[nH]c4ccccc34)c2c1=O)N1CCC[C@@H](N)C1

InChI Key: InChIKey=FOPUOCQAFLKFLE-GOSISDBHSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50431794   
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))		BDBM50431794
PNG
(CHEMBL2346923)
Show SMILES CC#CCn1c(nc2ccn(Cc3c[nH]c4ccccc34)c2c1=O)N1CCC[C@@H](N)C1 |r|
Show InChI InChI=1S/C24H26N6O/c1-2-3-12-30-23(31)22-21(27-24(30)29-11-6-7-18(25)16-29)10-13-28(22)15-17-14-26-20-9-5-4-8-19(17)20/h4-5,8-10,13-14,18,26H,6-7,11-12,15-16,25H2,1H3/t18-/m1/s1
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Article
PubMed
n/an/a 44n/an/an/an/an/an/a



Chinese Academy of Science

Curated by ChEMBL


Assay Description
Inhibition of human DPP4 using Gly-Pro-AMC as substrate treated with enzyme 10 mins prior to substrate addition measured after 10 mins

Bioorg Med Chem 21: 1749-55 (2013)


Article DOI: 10.1016/j.bmc.2013.01.062
BindingDB Entry DOI: 10.7270/Q2R78GMR
More data for this
Ligand-Target Pair