BDBM50276654 3-methyl-7-(3-methylbut-2-enyl)-8-((3aS,6aR)-octahydrocyclopenta[b]pyrrol-4-yl)-1-(2-oxo-2-phenylethyl)-3,4,5,7-tetrahydro-1H-purine-2,6-dione::CHEMBL459591::SR-162369

SMILES: [#6]-[#7]-1-[#6]-2-[#7]=[#6](-[#6]-3-[#6]-[#6]-[#6@H]-4-[#7]-[#6]-[#6]-[#6@@H]-3-4)-[#7](-[#6]\[#6]=[#6](\[#6])-[#6])-[#6]-2-[#6](=O)-[#7](-[#6]-[#6](=O)-c2ccccc2)-[#6]-1=O

InChI Key: InChIKey=IGPMAWDBGXRVEJ-YPPULQSKSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50276654   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Dipeptidyl peptidase 4 (Homo sapiens (Human))	BDBM50276654 (3-methyl-7-(3-methylbut-2-enyl)-8-((3aS,6aR)-octah...) Show SMILES [#6]-[#7]-1-[#6]-2-[#7]=[#6](-[#6]-3-[#6]-[#6]-[#6@H]-4-[#7]-[#6]-[#6]-[#6@@H]-3-4)-[#7](-[#6]\[#6]=[#6](\[#6])-[#6])-[#6]-2-[#6](=O)-[#7](-[#6]-[#6](=O)-c2ccccc2)-[#6]-1=O |r,t:3| Show InChI InChI=1S/C26H33N5O3/c1-16(2)12-14-30-22-24(28-23(30)19-9-10-20-18(19)11-13-27-20)29(3)26(34)31(25(22)33)15-21(32)17-7-5-4-6-8-17/h4-8,12,18-20,22,24,27H,9-11,13-15H2,1-3H3/t18-,19?,20+,22?,24?/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
Matrix Laboratories Limited Curated by ChEMBL					Assay Description Inhibition of DPP4				Bioorg Med Chem 17: 1783-802 (2009) Article DOI: 10.1016/j.bmc.2009.01.061 BindingDB Entry DOI: 10.7270/Q2VD70DJ
					More data for this Ligand-Target Pair