BindingDB logo
myBDB logout

null

SMILES: CCC(C)[C@@H](N)C(=O)N1[C@@H](CC[C@H]1c1ccccc1)C#N

InChI Key: InChIKey=PJINJOFRZXQDGL-XLMXVRBTSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 12634   
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))
BDBM12634
PNG
((2S,5S)-1-[(2R,3R)-2-amino-3-methylpentanoyl]-5-ph...)
Show SMILES CCC(C)[C@@H](N)C(=O)N1[C@@H](CC[C@H]1c1ccccc1)C#N |r|
Show InChI InChI=1S/C17H23N3O/c1-3-12(2)16(19)17(21)20-14(11-18)9-10-15(20)13-7-5-4-6-8-13/h4-8,12,14-16H,3,9-10,19H2,1-2H3/t12?,14-,15-,16+/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
>3.00E+4>-6.10n/an/an/an/an/a7.522



Abbott Laboratories



Assay Description
The DPP4 activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 355 nm and mea...


J Med Chem 49: 6416-20 (2006)


Article DOI: 10.1021/jm060777o
BindingDB Entry DOI: 10.7270/Q2M043M1
More data for this
Ligand-Target Pair