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BDBM50350176 CHEMBL1814751

SMILES: N[C@@H](CC(=O)N1CCN(CC1)C(=O)C1c2ccccc2-c2ccccc12)C(=O)N1Cc2ccccc2C1

InChI Key: InChIKey=QJFVRSIDRSQVDG-SANMLTNESA-N

Data: 3 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 3 hits for monomerid = 50350176   
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 VIII


(Homo sapiens (Human))
BDBM50350176
PNG
(CHEMBL1814751)
Show SMILES N[C@@H](CC(=O)N1CCN(CC1)C(=O)C1c2ccccc2-c2ccccc12)C(=O)N1Cc2ccccc2C1 |r|
Show InChI InChI=1S/C30H30N4O3/c31-26(29(36)34-18-20-7-1-2-8-21(20)19-34)17-27(35)32-13-15-33(16-14-32)30(37)28-24-11-5-3-9-22(24)23-10-4-6-12-25(23)28/h1-12,26,28H,13-19,31H2/t26-/m0/s1
PDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 166n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DPP8 assessed as pNA release from Ala-Pro- p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to sub...


J Med Chem 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50350176
PNG
(CHEMBL1814751)
Show SMILES N[C@@H](CC(=O)N1CCN(CC1)C(=O)C1c2ccccc2-c2ccccc12)C(=O)N1Cc2ccccc2C1 |r|
Show InChI InChI=1S/C30H30N4O3/c31-26(29(36)34-18-20-7-1-2-8-21(20)19-34)17-27(35)32-13-15-33(16-14-32)30(37)28-24-11-5-3-9-22(24)23-10-4-6-12-25(23)28/h1-12,26,28H,13-19,31H2/t26-/m0/s1
PDB
MMDB

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UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.90E+3n/an/an/an/an/an/a



University of Antwerp (UA)

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 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50350176
PNG
(CHEMBL1814751)
Show SMILES N[C@@H](CC(=O)N1CCN(CC1)C(=O)C1c2ccccc2-c2ccccc12)C(=O)N1Cc2ccccc2C1 |r|
Show InChI InChI=1S/C30H30N4O3/c31-26(29(36)34-18-20-7-1-2-8-21(20)19-34)17-27(35)32-13-15-33(16-14-32)30(37)28-24-11-5-3-9-22(24)23-10-4-6-12-25(23)28/h1-12,26,28H,13-19,31H2/t26-/m0/s1
PDB
MMDB

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antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



University of Antwerp (UA)

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 54: 5737-46 (2011)


Article DOI: 10.1021/jm200383j
BindingDB Entry DOI: 10.7270/Q2G73F37
More data for this
Ligand-Target Pair