BDBM50146968 (S)-2-Amino-4-(4-chloro-benzylamino)-1-(3,6-dihydro-2H-pyridin-1-yl)-butan-1-one::CHEMBL100370

SMILES: N[C@@H](CCNCc1ccc(Cl)cc1)C(=O)N1CCC=CC1

InChI Key: InChIKey=AIOHJGSPWFLIAI-HNNXBMFYSA-N

Data: 2 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 2 hits for monomerid = 50146968   

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))	BDBM50146968 ((S)-2-Amino-4-(4-chloro-benzylamino)-1-(3,6-dihydr...) Show SMILES N[C@@H](CCNCc1ccc(Cl)cc1)C(=O)N1CCC=CC1 |c:19| Show InChI InChI=1S/C16H22ClN3O/c17-14-6-4-13(5-7-14)12-19-9-8-15(18)16(21)20-10-2-1-3-11-20/h1-2,4-7,15,19H,3,8-12,18H2/t15-/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	1.48E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Antwerp Curated by ChEMBL					Assay Description Inhibition of human Dipeptidyl-peptidase IV (DPP IV)				J Med Chem 47: 2906-16 (2004) Article DOI: 10.1021/jm031122f BindingDB Entry DOI: 10.7270/Q2TH8M4H
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II) (Homo sapiens (Human))	BDBM50146968 ((S)-2-Amino-4-(4-chloro-benzylamino)-1-(3,6-dihydr...) Show SMILES N[C@@H](CCNCc1ccc(Cl)cc1)C(=O)N1CCC=CC1 |c:19| Show InChI InChI=1S/C16H22ClN3O/c17-14-6-4-13(5-7-14)12-19-9-8-15(18)16(21)20-10-2-1-3-11-20/h1-2,4-7,15,19H,3,8-12,18H2/t15-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.10	n/a	n/a	n/a	n/a	n/a	n/a
University of Antwerp Curated by ChEMBL					Assay Description Inhibition of human Dipeptidyl-peptidase II (DPP II)				J Med Chem 47: 2906-16 (2004) Article DOI: 10.1021/jm031122f BindingDB Entry DOI: 10.7270/Q2TH8M4H
					More data for this Ligand-Target Pair