DB07181
General
Type : Biphenyl,Carboxamide
Chemical_Nomenclature : 3-[4-[(1R)-1-amino-2-(2,5-difluorophenyl)ethyl]phenyl]benzamide
Canonical SMILES : C1=CC(=CC(=C1)C(=O)N)C2=CC=C(C=C2)C(CC3=C(C=CC(=C3)F)F)N
InChI : InChI=1S\/C21H18F2N2O\/c22-18-8-9-19(23)17(11-18)12-20(24)14-6-4-13(5-7-14)15-2-1-3-16(10-15)21(25)26\/h1-11,20H,12,24H2,(H2,25,26)\/t20-\/m1\/s1
InChIKey : JYKFWUXBFJJDTP-HXUWFJFHSA-N || JYKFWUXBFJJDTP-HXUWFJFHSA-O
Other name(s) : CHEMBL452289,4'-[(1r)-1-Amino-2-(2,5-Difluorophenyl)ethyl]biphenyl-3-Carboxamide,BDBM50244011,DB07181,3-{4-[(1R)-1-amino-2-(2,5-difluorophenyl)ethyl]phenyl}benzamide,4''-[(1R)-1-amino-2-(2,5-difluorophenyl)ethyl]biphenyl-3-carboxamide,605
MW : 352.38
Formula : C21H18F2N2O
CAS_number :
UniChem : JYKFWUXBFJJDTP-HXUWFJFHSA-N || JYKFWUXBFJJDTP-HXUWFJFHSA-O
IUPHAR :
Wikipedia :
Target
Families : DB07181 ligand of proteins in family: DPP4N_Peptidase_S9
Stucture : 3D4L Human dipeptidyl peptidase IV\/CD26 in complex with a novel inhibitor
Protein : human-DPP4
References (1)
| Title : Discovery of new binding elements in DPP-4 inhibition and their applications in novel DPP-4 inhibitor design - Liang_2008_Bioorg.Med.Chem.Lett_18_3706 |
| Author(s) : Liang GB , Qian X , Biftu T , Singh S , Gao YD , Scapin G , Patel S , Leiting B , Patel R , Wu J , Zhang X , Thornberry NA , Weber AE |
| Ref : Bioorganic & Medicinal Chemistry Lett , 18 :3706 , 2008 |
| Abstract : Liang_2008_Bioorg.Med.Chem.Lett_18_3706 |
| ESTHER : Liang_2008_Bioorg.Med.Chem.Lett_18_3706 |
| PubMedSearch : Liang_2008_Bioorg.Med.Chem.Lett_18_3706 |
| PubMedID: 18524582 |
| Gene_locus related to this paper: human-DPP4 |