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Compile Data Set for Download or QSAR

Found 3 hits of ic50 for monomerid = 50320298   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50320298
PNG
((2S,3aR,5beta,6aS)-5-(2-((S)-2-cyanopyrrolidin-1-y...)
Show SMILES CCN(CC)C(=O)O[C@@H]1C[C@@H]2C[C@@H](C[C@@H]2C1)NCC(=O)N1CCC[C@H]1C#N |r|
Show InChI InChI=1S/C20H32N4O3/c1-3-23(4-2)20(26)27-18-10-14-8-16(9-15(14)11-18)22-13-19(25)24-7-5-6-17(24)12-21/h14-18,22H,3-11,13H2,1-2H3/t14-,15+,16-,17-,18+/m0/s1
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PubMed
n/an/a 80n/an/an/an/an/an/a



Shanghai Hengrui Pharmaceuticals Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of DPP4 by chemical luminescent assay


Bioorg Med Chem Lett 20: 3521-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.138
BindingDB Entry DOI: 10.7270/Q2JH3MBT
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50320298
PNG
((2S,3aR,5beta,6aS)-5-(2-((S)-2-cyanopyrrolidin-1-y...)
Show SMILES CCN(CC)C(=O)O[C@@H]1C[C@@H]2C[C@@H](C[C@@H]2C1)NCC(=O)N1CCC[C@H]1C#N |r|
Show InChI InChI=1S/C20H32N4O3/c1-3-23(4-2)20(26)27-18-10-14-8-16(9-15(14)11-18)22-13-19(25)24-7-5-6-17(24)12-21/h14-18,22H,3-11,13H2,1-2H3/t14-,15+,16-,17-,18+/m0/s1
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PubMed
n/an/a 7.75E+3n/an/an/an/an/an/a



Shanghai Hengrui Pharmaceuticals Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of DPP9 by chemical luminescent assay


Bioorg Med Chem Lett 20: 3521-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.138
BindingDB Entry DOI: 10.7270/Q2JH3MBT
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50320298
PNG
((2S,3aR,5beta,6aS)-5-(2-((S)-2-cyanopyrrolidin-1-y...)
Show SMILES CCN(CC)C(=O)O[C@@H]1C[C@@H]2C[C@@H](C[C@@H]2C1)NCC(=O)N1CCC[C@H]1C#N |r|
Show InChI InChI=1S/C20H32N4O3/c1-3-23(4-2)20(26)27-18-10-14-8-16(9-15(14)11-18)22-13-19(25)24-7-5-6-17(24)12-21/h14-18,22H,3-11,13H2,1-2H3/t14-,15+,16-,17-,18+/m0/s1
PDB

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antibodypedia
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AffyNet 
CHEMBL
PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 1.27E+4n/an/an/an/an/an/a



Shanghai Hengrui Pharmaceuticals Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of DPP8 by chemical luminescent assay


Bioorg Med Chem Lett 20: 3521-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.138
BindingDB Entry DOI: 10.7270/Q2JH3MBT
More data for this
Ligand-Target Pair