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Inhibitor Report for: CHEMBL1910111

similar to CHEMBL1909991 CHEMBL1910114 CHEMBL2441952


General
Type Pyrrolidine, Pyridine, Pyrimidine
Chemical_Nomenclature methyl 2-[3-(aminomethyl)-4-(2,4-dichlorophenyl)-2-methyl-7-oxo-5H-pyrrolo[3,4-b]pyridin-6-yl]acetate
Canonical SMILES CC1=C(C(=C2CN(C(=O)C2=N1)CC(=O)OC)C3=C(C=C(C=C3)Cl)Cl)CN
InChI InChI=1S/C18H17Cl2N3O3/c1-9-12(6-21)16(11-4-3-10(19)5-14(11)20)13-7-23(8-15(24)26-2)18(25)17(13)22-9/h3-5H,6-8,21H2,1-2H3
InChIKey ZPJLWUGRTVIDEI-UHFFFAOYSA-N
Other name(s) SCHEMBL2705244 ; BDBM50356580 ; LGE ; Methyl [3-(Aminomethyl)-4-(2,4-Dichlorophenyl)-2-Methyl-7-Oxo-5,7-Dihydro-6h-Pyrrolo[3,4-B]pyridin-6-Yl]acetate
________________________________________________________________________________________________
MW|394.25
Formula|C18H17Cl2N3O3
CAS_number|
PubChem|15950538
UniChem|ZPJLWUGRTVIDEI-UHFFFAOYSA-N
IUPHAR|
Wikipedia|

Target
Families | CHEMBL1910111 ligand of proteins in family: DPP4N_Peptidase_S9
Stucture | 1 structure: 3Q0T: Crystal structure of human dpp-IV in complex with SA-(+)- methyl2-(3-(aminomethyl)-4-(2,4-dichlorophenyl)-2-methyl- 7-oxo-5H-pyrrolo[3,4-B]pyridin-6(7H)-yl)acetate
Protein | human-DPP4, human-DPP8

References:
Search PubMed for references concerning: CHEMBL1910111
    Title: Discovery of 6-(Aminomethyl)-5-(2,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyrimidine-2-carboxa mides as Potent, Selective Dipeptidyl Peptidase-4 (DPP4) Inhibitors
    Meng W, Brigance RP, Chao HJ, Fura A, Harrity T, Marcinkeviciene J, O'Connor SP, Tamura JK, Xie D and Hamann LG <8 more author(s)>
    Ref: Journal of Medicinal Chemistry, 53:5620, 2010 : PubMed