BDBM50207289 CHEMBL3920718

SMILES: CC#CCn1c(nc2n(C)c(=O)n(CCCCN3CCC(CC3)C(=O)OC(C)C)c(=O)c12)N1CCC[C@@H](N)C1

InChI Key: InChIKey=XPNLCZIPHRBXMF-JOCHJYFZSA-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 = 50207289   

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))	BDBM50207289 (CHEMBL3920718) Show SMILES CC#CCn1c(nc2n(C)c(=O)n(CCCCN3CCC(CC3)C(=O)OC(C)C)c(=O)c12)N1CCC[C@@H](N)C1 |r| Show InChI InChI=1S/C28H43N7O4/c1-5-6-15-34-23-24(30-27(34)33-14-9-10-22(29)19-33)31(4)28(38)35(25(23)36)16-8-7-13-32-17-11-21(12-18-32)26(37)39-20(2)3/h20-22H,7-19,29H2,1-4H3/t22-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Materia Medica Curated by ChEMBL					Assay Description Inhibition of DPP4 (unknown origin) using Gly-Pro-p-nitroanilide as substrate incubated for 1 hr				Eur J Med Chem 124: 103-116 (2016) Article DOI: 10.1016/j.ejmech.2016.08.023 BindingDB Entry DOI: 10.7270/Q2FJ2JRD
					More data for this Ligand-Target Pair