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Inhibitor Report for: Alogliptin

Alogliptin is a selective, orally bioavailable, pyrimidinedione-based inhibitor of dipeptidyl peptidase 4 (DPP-4), with hypoglycemic activity. Almost identical to Trelagliptin which is a fluride derivative (Alogliptin cation CID 26322458 in structure 3G0B)


General
Type Drug, Piperidine, Pyrimidine, Cyanide, Gliptin
Chemical_Nomenclature 2-[[6-[(3R)-3-aminopiperidin-1-yl]-3-methyl-2,4-dioxopyrimidin-1-yl]methyl]benzonitrile
Canonical SMILES CN1C(=O)C=C(N(C1=O)CC2=CC=CC=C2C#N)N3CCCC(C3)N
InChI InChI=1S/C18H21N5O2/c1-21-17(24)9-16(22-8-4-7-15(20)12-22)23(18(21)25)11-14-6-3-2-5-13(14)10-19/h2-3,5-6,9,15H,4,7-8,11-12,20H2,1H3/t15-/m1/s1
InChIKey ZSBOMTDTBDDKMP-OAHLLOKOSA-N
Other name(s) Alogliptina ; UNII-JHC049LO86 ; CHEMBL376359 ; TAK-322 ; Nesina ; SYR-322
________________________________________________________________________________________________
MW|339.39
Formula|C18H21N5O2
CAS_number|850649-61-5
PubChem|11450633
UniChem|ZSBOMTDTBDDKMP-OAHLLOKOSA-N
IUPHAR|6319
Wikipedia|Alogliptin

Target
Families | Alogliptin ligand of proteins in family: DPP4N_Peptidase_S9
Stucture | 2 structures: 3G0B, 2ONC
Protein | human-DPP4

References:
Search PubMed for references concerning: Alogliptin

20 more
    Title: Novel pyrrolopyrimidine analogues as potent dipeptidyl peptidase IV inhibitors based on pharmacokinetic property-driven optimization
    Xie H, Zeng L, Zeng S, Lu X, Zhang G, Zhao X, Cheng N, Tu Z, Li Z and Hu W <5 more author(s)>
    Ref: Eur Journal of Medicinal Chemistry, 52:205, 2012 : PubMed

            

    Title: Design and synthesis of pyrimidinone and pyrimidinedione inhibitors of dipeptidyl peptidase IV
    Zhang Z, Wallace MB, Feng J, Stafford JA, Skene RJ, Shi L, Lee B, Aertgeerts K, Jennings A and Gwaltney SL <5 more author(s)>
    Ref: Journal of Medicinal Chemistry, 54:510, 2011 : PubMed

            

    Title: Discovery of alogliptin: a potent, selective, bioavailable, and efficacious inhibitor of dipeptidyl peptidase IV
    Feng J, Zhang Z, Wallace MB, Stafford JA, Kaldor SW, Kassel DB, Navre M, Shi L, Skene RJ and Gwaltney SL, 2nd <4 more author(s)>
    Ref: Journal of Medicinal Chemistry, 50:2297, 2007 : PubMed