BindingDB PrimarySearch

BDBM50118950 (3S)-4-oxo-4-piperidin-1-ylbutane-1,3-diamine::(S)-2,4-Diamino-1-piperidin-1-yl-butan-1-one::CHEMBL93505::Dab-Pip

SMILES: NCC[C@H](N)C(=O)N1CCCCC1

InChI Key: InChIKey=RKBKYSFKXFKBBM-QMMMGPOBSA-N

Data: 5 IC50

PDB links: 1 PDB ID matches this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50118950
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Dipeptidyl peptidase 4 (Homo sapiens (Human))	BDBM50118950 ((3S)-4-oxo-4-piperidin-1-ylbutane-1,3-diamine \| (S...) Show SMILES NCC[C@H](N)C(=O)N1CCCCC1 \|r\| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	>1.00E+6	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
University of Antwerp Curated by ChEMBL					More data for this Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II) (Homo sapiens (Human))	BDBM50118950 ((3S)-4-oxo-4-piperidin-1-ylbutane-1,3-diamine \| (S...) Show SMILES NCC[C@H](N)C(=O)N1CCCCC1 \|r\| Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Similars	MMDB PDB Article PubMed	n/a	n/a	130	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
University of Antwerp Curated by ChEMBL					More data for this Ligand-Target Pair				3D Structure (crystal)
Dipeptidyl peptidase 2 (DPP II) (Homo sapiens (Human))	BDBM50118950 ((3S)-4-oxo-4-piperidin-1-ylbutane-1,3-diamine \| (S...) Show SMILES NCC[C@H](N)C(=O)N1CCCCC1 \|r\| Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Similars	MMDB PDB PubMed	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
University of Antwerp (UIA) Curated by ChEMBL					Assay Description In vitro inhibition of porcine Dipeptidylpeptidase II.				Bioorg Med Chem Lett 12: 2825-8 (2002) BindingDB Entry DOI: 10.7270/Q279457M
University of Antwerp (UIA) Curated by ChEMBL					More data for this Ligand-Target Pair				3D Structure (crystal)
Dipeptidyl peptidase 4 (Homo sapiens (Human))	BDBM50118950 ((3S)-4-oxo-4-piperidin-1-ylbutane-1,3-diamine \| (S...) Show SMILES NCC[C@H](N)C(=O)N1CCCCC1 \|r\| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Similars	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
University of Antwerp (UIA) Curated by ChEMBL					Assay Description In vitro inhibition of human Dipeptidylpeptidase IV.				Bioorg Med Chem Lett 12: 2825-8 (2002) BindingDB Entry DOI: 10.7270/Q279457M
University of Antwerp (UIA) Curated by ChEMBL					More data for this Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II) (Homo sapiens (Human))	BDBM50118950 ((3S)-4-oxo-4-piperidin-1-ylbutane-1,3-diamine \| (S...) Show SMILES NCC[C@H](N)C(=O)N1CCCCC1 \|r\| Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Similars	MMDB PDB Article PubMed	n/a	n/a	163	n/a	n/a	n/a	n/a	n/a	n/a
Ranbaxy Research Laboratories Curated by ChEMBL					Assay Description Inhibition of DPP2 (unknown origin)				Bioorg Med Chem Lett 18: 4087-91 (2008) Article DOI: 10.1016/j.bmcl.2008.05.101 BindingDB Entry DOI: 10.7270/Q2T153FC
Ranbaxy Research Laboratories Curated by ChEMBL					More data for this Ligand-Target Pair				3D Structure (crystal)