BDBM50275957 (R)-3-Amino-N-[4-(6-chloro-benzothiazol-2-yl)-1,1-dioxo-hexahydro-1lambda*6*-thiopyran-4-yl]-4-(2-fluoro-phenyl)-butyramide::CHEMBL469730

SMILES: N[C@@H](CC(=O)NC1(CCS(=O)(=O)CC1)c1nc2ccc(Cl)cc2s1)Cc1ccccc1F

InChI Key: InChIKey=JKUDQMGKWWSJAL-MRXNPFEDSA-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 = 50275957   

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))	BDBM50275957 ((R)-3-Amino-N-[4-(6-chloro-benzothiazol-2-yl)-1,1-...) Show SMILES N[C@@H](CC(=O)NC1(CCS(=O)(=O)CC1)c1nc2ccc(Cl)cc2s1)Cc1ccccc1F |r| Show InChI InChI=1S/C22H23ClFN3O3S2/c23-15-5-6-18-19(12-15)31-21(26-18)22(7-9-32(29,30)10-8-22)27-20(28)13-16(25)11-14-3-1-2-4-17(14)24/h1-6,12,16H,7-11,13,25H2,(H,27,28)/t16-/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	35	n/a	n/a	n/a	n/a	n/a	n/a
Toray Industries Inc. Curated by ChEMBL					Assay Description Inhibition of human Caco2 cells-derived DPP4				Bioorg Med Chem Lett 18: 5435-8 (2008) Article DOI: 10.1016/j.bmcl.2008.09.042 BindingDB Entry DOI: 10.7270/Q2QV3MC8
					More data for this Ligand-Target Pair