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Compile Data Set for Download or QSAR

Found 5 hits of ic50 for monomerid = 50338434   
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))
BDBM50338434
PNG
((R)-2-(2,5-difluorophenyl)-1-(1-(pyrimidin-5-yl)pi...)
Show SMILES N[C@H](Cc1cc(F)ccc1F)C1CCN(CC1)c1cncnc1 |r|
Show InChI InChI=1S/C17H20F2N4/c18-14-1-2-16(19)13(7-14)8-17(20)12-3-5-23(6-4-12)15-9-21-11-22-10-15/h1-2,7,9-12,17H,3-6,8,20H2/t17-/m1/s1
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n/an/a 75n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP4


Bioorg Med Chem Lett 21: 1880-6 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.060
BindingDB Entry DOI: 10.7270/Q2SX6DJG
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50338434
PNG
((R)-2-(2,5-difluorophenyl)-1-(1-(pyrimidin-5-yl)pi...)
Show SMILES N[C@H](Cc1cc(F)ccc1F)C1CCN(CC1)c1cncnc1 |r|
Show InChI InChI=1S/C17H20F2N4/c18-14-1-2-16(19)13(7-14)8-17(20)12-3-5-23(6-4-12)15-9-21-11-22-10-15/h1-2,7,9-12,17H,3-6,8,20H2/t17-/m1/s1
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n/an/a 1.60E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP9


Bioorg Med Chem Lett 21: 1880-6 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.060
BindingDB Entry DOI: 10.7270/Q2SX6DJG
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50338434
PNG
((R)-2-(2,5-difluorophenyl)-1-(1-(pyrimidin-5-yl)pi...)
Show SMILES N[C@H](Cc1cc(F)ccc1F)C1CCN(CC1)c1cncnc1 |r|
Show InChI InChI=1S/C17H20F2N4/c18-14-1-2-16(19)13(7-14)8-17(20)12-3-5-23(6-4-12)15-9-21-11-22-10-15/h1-2,7,9-12,17H,3-6,8,20H2/t17-/m1/s1
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n/an/a 3.50E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8


Bioorg Med Chem Lett 21: 1880-6 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.060
BindingDB Entry DOI: 10.7270/Q2SX6DJG
More data for this
Ligand-Target Pair
Prolyl endopeptidase FAP


(Homo sapiens (Human))
BDBM50338434
PNG
((R)-2-(2,5-difluorophenyl)-1-(1-(pyrimidin-5-yl)pi...)
Show SMILES N[C@H](Cc1cc(F)ccc1F)C1CCN(CC1)c1cncnc1 |r|
Show InChI InChI=1S/C17H20F2N4/c18-14-1-2-16(19)13(7-14)8-17(20)12-3-5-23(6-4-12)15-9-21-11-22-10-15/h1-2,7,9-12,17H,3-6,8,20H2/t17-/m1/s1
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n/an/a>3.50E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of FAP


Bioorg Med Chem Lett 21: 1880-6 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.060
BindingDB Entry DOI: 10.7270/Q2SX6DJG
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2


(Homo sapiens (Human))
BDBM50338434
PNG
((R)-2-(2,5-difluorophenyl)-1-(1-(pyrimidin-5-yl)pi...)
Show SMILES N[C@H](Cc1cc(F)ccc1F)C1CCN(CC1)c1cncnc1 |r|
Show InChI InChI=1S/C17H20F2N4/c18-14-1-2-16(19)13(7-14)8-17(20)12-3-5-23(6-4-12)15-9-21-11-22-10-15/h1-2,7,9-12,17H,3-6,8,20H2/t17-/m1/s1
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Article
PubMed
n/an/a 3.50E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of QPP


Bioorg Med Chem Lett 21: 1880-6 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.060
BindingDB Entry DOI: 10.7270/Q2SX6DJG
More data for this
Ligand-Target Pair