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BDBM50146963 6-((S)-3-Amino-4-oxo-4-piperidin-1-yl-butylamino)-nicotinonitrile::CHEMBL418788

SMILES: N[C@@H](CCNc1ccc(cn1)C#N)C(=O)N1CCCCC1

InChI Key: InChIKey=WGNWOSQRJCHYPW-ZDUSSCGKSA-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 = 50146963   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50146963
PNG
(6-((S)-3-Amino-4-oxo-4-piperidin-1-yl-butylamino)-...)
Show SMILES N[C@@H](CCNc1ccc(cn1)C#N)C(=O)N1CCCCC1
Show InChI InChI=1S/C15H21N5O/c16-10-12-4-5-14(19-11-12)18-7-6-13(17)15(21)20-8-2-1-3-9-20/h4-5,11,13H,1-3,6-9,17H2,(H,18,19)/t13-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.60n/an/an/an/an/an/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
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50146963
PNG
(6-((S)-3-Amino-4-oxo-4-piperidin-1-yl-butylamino)-...)
Show SMILES N[C@@H](CCNc1ccc(cn1)C#N)C(=O)N1CCCCC1
Show InChI InChI=1S/C15H21N5O/c16-10-12-4-5-14(19-11-12)18-7-6-13(17)15(21)20-8-2-1-3-9-20/h4-5,11,13H,1-3,6-9,17H2,(H,18,19)/t13-/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.05E+5n/an/an/an/an/an/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