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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dipeptidyl peptidase 4' and Ligand = 'BDBM50225425'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50225425
PNG
(CHEMBL440982 | di-(4-acetamido)phenyl 2-((S)-2,6-d...)
Show SMILES CC(=O)Nc1ccc(OP(=O)(Oc2ccc(NC(C)=O)cc2)C2N(Cc3ccccc23)C(=O)[C@@H](N)CCCCN)cc1
Show InChI InChI=1S/C30H36N5O6P/c1-20(36)33-23-10-14-25(15-11-23)40-42(39,41-26-16-12-24(13-17-26)34-21(2)37)30-27-8-4-3-7-22(27)19-35(30)29(38)28(32)9-5-6-18-31/h3-4,7-8,10-17,28,30H,5-6,9,18-19,31-32H2,1-2H3,(H,33,36)(H,34,37)/t28-,30?/m0/s1
PDB
MMDB

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Similars

Article
PubMed
n/an/a>5.00E+5n/an/an/an/an/an/a



University of Antwerp

Curated by ChEMBL


Assay Description
Inhibition of human DPP4


J Med Chem 50: 5568-70 (2007)


Article DOI: 10.1021/jm701005a
BindingDB Entry DOI: 10.7270/Q2S75G2R
More data for this
Ligand-Target Pair