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BDBM50170695 (S)-1-{(S)-1-[3-(Pyrrolidine-1-carbonyl)-benzoyl]-pyrrolidine-2-carbonyl}-pyrrolidine-2-carbonitrile::CHEMBL191061

SMILES: O=C([C@@H]1CCCN1C(=O)c1cccc(c1)C(=O)N1CCCC1)N1CCC[C@H]1C#N

InChI Key: InChIKey=ZDXNXRUACQGMNP-OALUTQOASA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50170695   
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
Prolyl endopeptidase


(Sus scrofa)
BDBM50170695
PNG
((S)-1-{(S)-1-[3-(Pyrrolidine-1-carbonyl)-benzoyl]-...)
Show SMILES O=C([C@@H]1CCCN1C(=O)c1cccc(c1)C(=O)N1CCCC1)N1CCC[C@H]1C#N
Show InChI InChI=1S/C22H26N4O3/c23-15-18-8-4-12-25(18)22(29)19-9-5-13-26(19)21(28)17-7-3-6-16(14-17)20(27)24-10-1-2-11-24/h3,6-7,14,18-19H,1-2,4-5,8-13H2/t18-,19-/m0/s1
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.90n/an/an/an/a7.0n/a



University of Kuopio

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against porcine prolyl oligopeptidase by using 4 mM Suc-Gly-Pro-7-amido-4-methylcoumarin as substrate (pH 7.0) at 30 deg...


J Med Chem 48: 4772-82 (2005)


Article DOI: 10.1021/jm0500020
BindingDB Entry DOI: 10.7270/Q22B8ZT2
More data for this
Ligand-Target Pair