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BDBM50350168 CHEMBL1814740

SMILES: N[C@@H](CC(=O)N1CCN(CC1)C(c1ccccc1)c1ccc(Cl)cc1)C(=O)N1Cc2ccc(F)cc2C1

InChI Key: InChIKey=QFXCEXQJGXBAQP-QODXOHEASA-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 = 50350168   
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))
BDBM50350168
PNG
(CHEMBL1814740)
Show SMILES N[C@@H](CC(=O)N1CCN(CC1)C(c1ccccc1)c1ccc(Cl)cc1)C(=O)N1Cc2ccc(F)cc2C1 |r|
Show InChI InChI=1S/C29H30ClFN4O2/c30-24-9-6-21(7-10-24)28(20-4-2-1-3-5-20)34-14-12-33(13-15-34)27(36)17-26(32)29(37)35-18-22-8-11-25(31)16-23(22)19-35/h1-11,16,26,28H,12-15,17-19,32H2/t26-,28?/m0/s1
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PC sid
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Similars

Article
PubMed
n/an/a 8.80n/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))
BDBM50350168
PNG
(CHEMBL1814740)
Show SMILES N[C@@H](CC(=O)N1CCN(CC1)C(c1ccccc1)c1ccc(Cl)cc1)C(=O)N1Cc2ccc(F)cc2C1 |r|
Show InChI InChI=1S/C29H30ClFN4O2/c30-24-9-6-21(7-10-24)28(20-4-2-1-3-5-20)34-14-12-33(13-15-34)27(36)17-26(32)29(37)35-18-22-8-11-25(31)16-23(22)19-35/h1-11,16,26,28H,12-15,17-19,32H2/t26-,28?/m0/s1
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MMDB

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UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a>2.50E+4n/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))
BDBM50350168
PNG
(CHEMBL1814740)
Show SMILES N[C@@H](CC(=O)N1CCN(CC1)C(c1ccccc1)c1ccc(Cl)cc1)C(=O)N1Cc2ccc(F)cc2C1 |r|
Show InChI InChI=1S/C29H30ClFN4O2/c30-24-9-6-21(7-10-24)28(20-4-2-1-3-5-20)34-14-12-33(13-15-34)27(36)17-26(32)29(37)35-18-22-8-11-25(31)16-23(22)19-35/h1-11,16,26,28H,12-15,17-19,32H2/t26-,28?/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>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