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2 similar compounds to monomer 12183

Compile data set for download or QSAR
Wt: 454.4
BDBM50382271
Wt: 523.5
BDBM50382273

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 50382271,50382273   
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 2 (DPP II)


(Homo sapiens (Human))
BDBM50382271
PNG
(CHEMBL2022518)
Show SMILES Fc1ccc(cc1)C(NC(=O)CCC(=O)NCC(=O)N1CCC[C@H]1C#N)c1ccc(F)cc1
Show InChI InChI=1S/C24H24F2N4O3/c25-18-7-3-16(4-8-18)24(17-5-9-19(26)10-6-17)29-22(32)12-11-21(31)28-15-23(33)30-13-1-2-20(30)14-27/h3-10,20,24H,1-2,11-13,15H2,(H,28,31)(H,29,32)/t20-/m0/s1
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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 DPP2 assessed as pNA release from Lys-Ala-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


Bioorg Med Chem Lett 22: 3412-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.107
BindingDB Entry DOI: 10.7270/Q27D2W5P
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50382273
PNG
(CHEMBL2022520)
Show SMILES Fc1ccc(cc1)C(N1CCN(CC1)C(=O)CCC(=O)NCC(=O)N1CCC[C@H]1C#N)c1ccc(F)cc1
Show InChI InChI=1S/C28H31F2N5O3/c29-22-7-3-20(4-8-22)28(21-5-9-23(30)10-6-21)34-16-14-33(15-17-34)26(37)12-11-25(36)32-19-27(38)35-13-1-2-24(35)18-31/h3-10,24,28H,1-2,11-17,19H2,(H,32,36)/t24-/m0/s1
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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 DPP2 assessed as pNA release from Lys-Ala-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


Bioorg Med Chem Lett 22: 3412-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.107
BindingDB Entry DOI: 10.7270/Q27D2W5P
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50382271
PNG
(CHEMBL2022518)
Show SMILES Fc1ccc(cc1)C(NC(=O)CCC(=O)NCC(=O)N1CCC[C@H]1C#N)c1ccc(F)cc1
Show InChI InChI=1S/C24H24F2N4O3/c25-18-7-3-16(4-8-18)24(17-5-9-19(26)10-6-17)29-22(32)12-11-21(31)28-15-23(33)30-13-1-2-20(30)14-27/h3-10,20,24H,1-2,11-13,15H2,(H,28,31)(H,29,32)/t20-/m0/s1
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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...


Bioorg Med Chem Lett 22: 3412-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.107
BindingDB Entry DOI: 10.7270/Q27D2W5P
More data for this
Ligand-Target Pair
Fibroblast activation protein (FAP)


(Mus musculus (Mouse))
BDBM50382271
PNG
(CHEMBL2022518)
Show SMILES Fc1ccc(cc1)C(NC(=O)CCC(=O)NCC(=O)N1CCC[C@H]1C#N)c1ccc(F)cc1
Show InChI InChI=1S/C24H24F2N4O3/c25-18-7-3-16(4-8-18)24(17-5-9-19(26)10-6-17)29-22(32)12-11-21(31)28-15-23(33)30-13-1-2-20(30)14-27/h3-10,20,24H,1-2,11-13,15H2,(H,28,31)(H,29,32)/t20-/m0/s1
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PubMed
n/an/a 2.00E+4n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant FAP expressed in HEK293 cells assessed as pNA release from Ala-Pro-p-nitroanilide pre-incubated with enzyme for 15 mi...


Bioorg Med Chem Lett 22: 3412-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.107
BindingDB Entry DOI: 10.7270/Q27D2W5P
More data for this
Ligand-Target Pair
Prolyl endopeptidase


(Homo sapiens (Human))
BDBM50382271
PNG
(CHEMBL2022518)
Show SMILES Fc1ccc(cc1)C(NC(=O)CCC(=O)NCC(=O)N1CCC[C@H]1C#N)c1ccc(F)cc1
Show InChI InChI=1S/C24H24F2N4O3/c25-18-7-3-16(4-8-18)24(17-5-9-19(26)10-6-17)29-22(32)12-11-21(31)28-15-23(33)30-13-1-2-20(30)14-27/h3-10,20,24H,1-2,11-13,15H2,(H,28,31)(H,29,32)/t20-/m0/s1
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PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PREP expressed in Escherichia coli assessed as pNA release from Z-Gly-Pro-p-nitroanilide pre-incubated with enzyme fo...


Bioorg Med Chem Lett 22: 3412-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.107
BindingDB Entry DOI: 10.7270/Q27D2W5P
More data for this
Ligand-Target Pair
Prolyl endopeptidase


(Homo sapiens (Human))
BDBM50382273
PNG
(CHEMBL2022520)
Show SMILES Fc1ccc(cc1)C(N1CCN(CC1)C(=O)CCC(=O)NCC(=O)N1CCC[C@H]1C#N)c1ccc(F)cc1
Show InChI InChI=1S/C28H31F2N5O3/c29-22-7-3-20(4-8-22)28(21-5-9-23(30)10-6-21)34-16-14-33(15-17-34)26(37)12-11-25(36)32-19-27(38)35-13-1-2-24(35)18-31/h3-10,24,28H,1-2,11-17,19H2,(H,32,36)/t24-/m0/s1
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Article
PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PREP expressed in Escherichia coli assessed as pNA release from Z-Gly-Pro-p-nitroanilide pre-incubated with enzyme fo...


Bioorg Med Chem Lett 22: 3412-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.107
BindingDB Entry DOI: 10.7270/Q27D2W5P
More data for this
Ligand-Target Pair
Fibroblast activation protein (FAP)


(Mus musculus (Mouse))
BDBM50382273
PNG
(CHEMBL2022520)
Show SMILES Fc1ccc(cc1)C(N1CCN(CC1)C(=O)CCC(=O)NCC(=O)N1CCC[C@H]1C#N)c1ccc(F)cc1
Show InChI InChI=1S/C28H31F2N5O3/c29-22-7-3-20(4-8-22)28(21-5-9-23(30)10-6-21)34-16-14-33(15-17-34)26(37)12-11-25(36)32-19-27(38)35-13-1-2-24(35)18-31/h3-10,24,28H,1-2,11-17,19H2,(H,32,36)/t24-/m0/s1
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Article
PubMed
n/an/a 1.99E+4n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant FAP expressed in HEK293 cells assessed as pNA release from Ala-Pro-p-nitroanilide pre-incubated with enzyme for 15 mi...


Bioorg Med Chem Lett 22: 3412-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.107
BindingDB Entry DOI: 10.7270/Q27D2W5P
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50382273
PNG
(CHEMBL2022520)
Show SMILES Fc1ccc(cc1)C(N1CCN(CC1)C(=O)CCC(=O)NCC(=O)N1CCC[C@H]1C#N)c1ccc(F)cc1
Show InChI InChI=1S/C28H31F2N5O3/c29-22-7-3-20(4-8-22)28(21-5-9-23(30)10-6-21)34-16-14-33(15-17-34)26(37)12-11-25(36)32-19-27(38)35-13-1-2-24(35)18-31/h3-10,24,28H,1-2,11-17,19H2,(H,32,36)/t24-/m0/s1
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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...


Bioorg Med Chem Lett 22: 3412-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.107
BindingDB Entry DOI: 10.7270/Q27D2W5P
More data for this
Ligand-Target Pair