N-acyl-prolylpyrrolidine-inhibitor-3
General
Type : Pyrrolidine,Triazol
Chemical_Nomenclature : 1-[(2S,4S)-4-[4-(4-fluorophenyl)triazol-1-yl]-2-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl]-4-phenylbutan-1-one
Canonical SMILES : C1CCN(C1)C(=O)C2CC(CN2C(=O)CCCC3=CC=CC=C3)N4C=C(N=N4)C5=CC=C(C=C5)F
InChI : InChI=1S\/C27H30FN5O2\/c28-22-13-11-21(12-14-22)24-19-33(30-29-24)23-17-25(27(35)31-15-4-5-16-31)32(18-23)26(34)10-6-9-20-7-2-1-3-8-20\/h1-3,7-8,11-14,19,23,25H,4-6,9-10,15-18H2\/t23-,25-\/m0\/s1
InChIKey : LGXNBGWSOROIQH-ZCYQVOJMSA-N
Other name(s) : CHEMBL2178963,BDBM50399734,1-[(2s,4s)-4-[4-(4-Fluorophenyl)-1,2,3-Triazol-1-Yl]-2-Pyrrolidin-1-Ylcarbonyl-Pyrrolidin-1-Yl]-4-Phenyl-Butan-1-One,TDV
MW : 475.56
Formula : C27H30FN5O2
CAS_number :
PubChem : 70789754
UniChem : LGXNBGWSOROIQH-ZCYQVOJMSA-N
IUPHAR :
Wikipedia :
Target
Families : N-acyl-prolylpyrrolidine-inhibitor-3 ligand of proteins in family: S9N_PPCE_Peptidase_S9
Stucture : 4BCD Prolyl Oligopeptidase from porcine brain with a non-covalently bound P2- substituted N-acyl-prolylpyrrolidine inhibitor 3
Protein : pig-ppce
References (1)
| Title : P2-substituted N-acylprolylpyrrolidine inhibitors of prolyl oligopeptidase: biochemical evaluation, binding mode determination, and assessment in a cellular model of synucleinopathy - Van der Veken_2012_J.Med.Chem_55_9856 |
| Author(s) : Van der Veken P , Fulop V , Rea D , Gerard M , Van Elzen R , Joossens J , Cheng JD , Baekelandt V , De Meester I , Lambeir AM , Augustyns K |
| Ref : Journal of Medicinal Chemistry , 55 :9856 , 2012 |
| Abstract : Van der Veken_2012_J.Med.Chem_55_9856 |
| ESTHER : Van der Veken_2012_J.Med.Chem_55_9856 |
| PubMedSearch : Van der Veken_2012_J.Med.Chem_55_9856 |
| PubMedID: 23121075 |
| Gene_locus related to this paper: pig-ppce |