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BDBM50146967 (S)-2-Amino-4-dibenzylamino-1-piperidin-1-yl-butan-1-one::CHEMBL97970

SMILES: N[C@@H](CCN(Cc1ccccc1)Cc1ccccc1)C(=O)N1CCCCC1

InChI Key: InChIKey=TZEHYYIAYWKDLU-QFIPXVFZSA-N

Data: 2 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50146967   
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 4


(Homo sapiens (Human))
BDBM50146967
PNG
((S)-2-Amino-4-dibenzylamino-1-piperidin-1-yl-butan...)
Show SMILES N[C@@H](CCN(Cc1ccccc1)Cc1ccccc1)C(=O)N1CCCCC1
Show InChI InChI=1S/C23H31N3O/c24-22(23(27)26-15-8-3-9-16-26)14-17-25(18-20-10-4-1-5-11-20)19-21-12-6-2-7-13-21/h1-2,4-7,10-13,22H,3,8-9,14-19,24H2/t22-/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.66E+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
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50146967
PNG
((S)-2-Amino-4-dibenzylamino-1-piperidin-1-yl-butan...)
Show SMILES N[C@@H](CCN(Cc1ccccc1)Cc1ccccc1)C(=O)N1CCCCC1
Show InChI InChI=1S/C23H31N3O/c24-22(23(27)26-15-8-3-9-16-26)14-17-25(18-20-10-4-1-5-11-20)19-21-12-6-2-7-13-21/h1-2,4-7,10-13,22H,3,8-9,14-19,24H2/t22-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 0.600n/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