Z-Pro-Prolinal-IC3

General

Type : Benzyloxycarbonyl,Pyrrolidine,Peptide,Cyanide

Chemical_Nomenclature : (2S)-1-[(2S)-1-(4-phenylbutanoyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carbonitrile

Canonical SMILES : C1CC(N(C1)C(=O)C2CCCN2C(=O)CCCC3=CC=CC=C3)C#N

InChI : InChI=1S\/C20H25N3O2\/c21-15-17-10-5-13-22(17)20(25)18-11-6-14-23(18)19(24)12-4-9-16-7-2-1-3-8-16\/h1-3,7-8,17-18H,4-6,9-14H2\/t17-,18-\/m0\/s1

InChIKey : SPXFAUXQZWJGCJ-ROUUACIJSA-N

Other name(s) : IC3,2P6,CHEMBL189620,4an0,KYP-2047,BDBM50155838,ZINC13584669,KYP-2047, >=95\% (HPLC)


MW : 339.43

Formula : C20H25N3O2

CAS_number :

PubChem : 11198569

UniChem : SPXFAUXQZWJGCJ-ROUUACIJSA-N

IUPHAR :

Wikipedia :

Target

Families : Z-Pro-Prolinal-IC3 ligand of proteins in family: S9N_PPCE_Peptidase_S9

Stucture : 4AN0 Prolyl Oligopeptidase from porcine brain with a covalently bound inhibitor IC-3

Protein : pig-ppce

References (2)

Title : A prolyl oligopeptidase inhibitor, KYP-2047, reduces alpha-synuclein protein levels and aggregates in cellular and animal models of Parkinson's disease - Myohanen_2012_Br.J.Pharmacol_166_1097
Author(s) : Myohanen TT , Hannula MJ , Van Elzen R , Gerard M , Van der Veken P , Garcia-Horsman JA , Baekelandt V , Mannisto PT , Lambeir AM
Ref : British Journal of Pharmacology , 166 :1097 , 2012
Abstract : Myohanen_2012_Br.J.Pharmacol_166_1097
ESTHER : Myohanen_2012_Br.J.Pharmacol_166_1097
PubMedSearch : Myohanen_2012_Br.J.Pharmacol_166_1097
PubMedID: 22233220

Title : Molecular dynamics, crystallography and mutagenesis studies on the substrate gating mechanism of prolyl oligopeptidase. - Kaszuba_2012_Biochimie_94_1398
Author(s) : Kaszuba K , Rog T , Danne R , Canning P , Fulop V , Juhasz T , Szeltner Z , St Pierre JF , Garcia-Horsman A , Mannisto PT , Karttunen M , Hokkanen J , Bunker A
Ref : Biochimie , 94 :1398 , 2012
Abstract : Kaszuba_2012_Biochimie_94_1398
ESTHER : Kaszuba_2012_Biochimie_94_1398
PubMedSearch : Kaszuba_2012_Biochimie_94_1398
PubMedID: 22484394
Gene_locus related to this paper: pig-ppce