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BDBM11066 (2S)-1-{[(2S,5R)-5-phenylpyrrolidin-2-yl]carbonyl}pyrrolidine-2-carbonitrile::2-cyanopyrrolidine 10j

SMILES: O=C([C@@H]1CC[C@@H](N1)c1ccccc1)N1CCC[C@H]1C#N

InChI Key: InChIKey=JTCUTSIXBKGWKW-ZNMIVQPWSA-N

Data: 1 KI

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 11066   
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))
BDBM11066
PNG
((2S)-1-{[(2S,5R)-5-phenylpyrrolidin-2-yl]carbonyl}...)
Show SMILES O=C([C@@H]1CC[C@@H](N1)c1ccccc1)N1CCC[C@H]1C#N |r|
Show InChI InChI=1S/C16H19N3O/c17-11-13-7-4-10-19(13)16(20)15-9-8-14(18-15)12-5-2-1-3-6-12/h1-3,5-6,13-15,18H,4,7-10H2/t13-,14+,15-/m0/s1
PDB
MMDB

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Similars

Article
PubMed
720 -8.29n/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: 3520-35 (2006)


Article DOI: 10.1021/jm051283e
BindingDB Entry DOI: 10.7270/Q2WS8RG1
More data for this
Ligand-Target Pair