BDBM50026018 2-Amino-N-(1-benzyl-3-methanesulfonyl-allyl)-acetamide::CHEMBL13279

SMILES: CS(=O)(=O)\C=C\C(Cc1ccccc1)NC(=O)CN

InChI Key: InChIKey=DLBCEDMSCPLRMY-BQYQJAHWSA-N

Data: 1 KI

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 = 50026018   

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 I (Homo sapiens (Human))	BDBM50026018 (2-Amino-N-(1-benzyl-3-methanesulfonyl-allyl)-aceta...) Show SMILES CS(=O)(=O)\C=C\C(Cc1ccccc1)NC(=O)CN Show InChI InChI=1S/C13H18N2O3S/c1-19(17,18)8-7-12(15-13(16)10-14)9-11-5-3-2-4-6-11/h2-8,12H,9-10,14H2,1H3,(H,15,16)/b8-7+	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.80E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for Inhibition of Dipeptidyl aminopeptidase 1				J Med Chem 29: 104-11 (1986) BindingDB Entry DOI: 10.7270/Q2542MKC
					More data for this Ligand-Target Pair