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BDBM50399725 CHEMBL2178972

SMILES: CN(C)Cc1cn(nn1)[C@H]1C[C@H](N(C1)C(=O)CCCc1ccccc1)C(=O)N1CCCC1

InChI Key: InChIKey=RWHQITUHAXJAQA-VXKWHMMOSA-N

Data: 3 IC50

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

Found 3 hits for monomerid = 50399725   
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))
BDBM50399725
PNG
(CHEMBL2178972)
Show SMILES CN(C)Cc1cn(nn1)[C@H]1C[C@H](N(C1)C(=O)CCCc1ccccc1)C(=O)N1CCCC1 |r|
Show InChI InChI=1S/C24H34N6O2/c1-27(2)16-20-17-30(26-25-20)21-15-22(24(32)28-13-6-7-14-28)29(18-21)23(31)12-8-11-19-9-4-3-5-10-19/h3-5,9-10,17,21-22H,6-8,11-16,18H2,1-2H3/t21-,22-/m0/s1
PDB
MMDB

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Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



University of Antwerp

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP4 assessed as pNA release from Gly-Pro-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 55: 9856-67 (2012)


Article DOI: 10.1021/jm301060g
BindingDB Entry DOI: 10.7270/Q2SN0B3S
More data for this
Ligand-Target Pair
Prolyl endopeptidase


(Sus scrofa)
BDBM50399725
PNG
(CHEMBL2178972)
Show SMILES CN(C)Cc1cn(nn1)[C@H]1C[C@H](N(C1)C(=O)CCCc1ccccc1)C(=O)N1CCCC1 |r|
Show InChI InChI=1S/C24H34N6O2/c1-27(2)16-20-17-30(26-25-20)21-15-22(24(32)28-13-6-7-14-28)29(18-21)23(31)12-8-11-19-9-4-3-5-10-19/h3-5,9-10,17,21-22H,6-8,11-16,18H2,1-2H3/t21-,22-/m0/s1
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PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 24n/an/an/an/an/an/a



University of Antwerp

Curated by ChEMBL


Assay Description
Inhibition of pig PREP expressed in Escherichia coli using Z-Gly-Pro-p-nitroanilide substrate


J Med Chem 55: 9856-67 (2012)


Article DOI: 10.1021/jm301060g
BindingDB Entry DOI: 10.7270/Q2SN0B3S
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50399725
PNG
(CHEMBL2178972)
Show SMILES CN(C)Cc1cn(nn1)[C@H]1C[C@H](N(C1)C(=O)CCCc1ccccc1)C(=O)N1CCCC1 |r|
Show InChI InChI=1S/C24H34N6O2/c1-27(2)16-20-17-30(26-25-20)21-15-22(24(32)28-13-6-7-14-28)29(18-21)23(31)12-8-11-19-9-4-3-5-10-19/h3-5,9-10,17,21-22H,6-8,11-16,18H2,1-2H3/t21-,22-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



University of Antwerp

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP2 assessed as pNA release from Lys-Ala-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 55: 9856-67 (2012)


Article DOI: 10.1021/jm301060g
BindingDB Entry DOI: 10.7270/Q2SN0B3S
More data for this
Ligand-Target Pair