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Patent code US8772508

Compile Data Set for Download or QSAR
Found 17 hits of Enzyme Inhibition Constant Data   
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
Glutaminyl-peptide cyclotransferase-like protein


(Homo sapiens (Human))
BDBM124974
PNG
(US8772508, 8)
Show SMILES Cc1cncn1CCCCN\C(NC1CCCCC1)=C/[N+]([O-])=O
Show InChI InChI=1S/C16H27N5O2/c1-14-11-17-13-20(14)10-6-5-9-18-16(12-21(22)23)19-15-7-3-2-4-8-15/h11,13,15H,2-10,12H2,1H3,(H,18,19)
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US Patent
11n/a 580n/an/an/an/a8.0n/a



Probiodrug AG

US Patent


Assay Description
All measurements were performed with a BioAssay Reader HTS-7000Plus for microplates (Perkin Elmer) at 30C. QC activity was evaluated fluorometrically...


US Patent US8772508 (2014)


BindingDB Entry DOI: 10.7270/Q2R78CW3
More data for this
Ligand-Target Pair
Glutaminyl-peptide cyclotransferase-like protein


(Homo sapiens (Human))
BDBM50299866
PNG
(CHEMBL578153 | N-(1-(3-(5-Methyl-1H-imidazol-1-yl)...)
Show SMILES Cc1cncn1CCCN=C(C[N+]([O-])=O)Nc1ccc(cc1)C(F)(F)F |w:9.9|
Show InChI InChI=1S/C16H18F3N5O2/c1-12-9-20-11-23(12)8-2-7-21-15(10-24(25)26)22-14-5-3-13(4-6-14)16(17,18)19/h3-6,9,11H,2,7-8,10H2,1H3,(H,21,22)
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US Patent
34n/a 430n/an/an/an/a8.0n/a



Probiodrug AG

US Patent


Assay Description
All measurements were performed with a BioAssay Reader HTS-7000Plus for microplates (Perkin Elmer) at 30C. QC activity was evaluated fluorometrically...


US Patent US8772508 (2014)


BindingDB Entry DOI: 10.7270/Q2R78CW3
More data for this
Ligand-Target Pair
Glutaminyl-peptide cyclotransferase-like protein


(Homo sapiens (Human))
BDBM50299867
PNG
(CHEMBL565907 | N-(1-(3-(5-Methyl-1H-imidazol-1-yl)...)
Show SMILES Cc1cncn1CCCN=C(C[N+]([O-])=O)Nc1cccc2ccccc12 |w:9.9|
Show InChI InChI=1S/C19H21N5O2/c1-15-12-20-14-23(15)11-5-10-21-19(13-24(25)26)22-18-9-4-7-16-6-2-3-8-17(16)18/h2-4,6-9,12,14H,5,10-11,13H2,1H3,(H,21,22)
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US Patent
41n/a 230n/an/an/an/a8.0n/a



Probiodrug AG

US Patent


Assay Description
All measurements were performed with a BioAssay Reader HTS-7000Plus for microplates (Perkin Elmer) at 30C. QC activity was evaluated fluorometrically...


US Patent US8772508 (2014)


BindingDB Entry DOI: 10.7270/Q2R78CW3
More data for this
Ligand-Target Pair
Glutaminyl-peptide cyclotransferase-like protein


(Homo sapiens (Human))
BDBM50299865
PNG
(CHEMBL567406 | N-(-1-(3-(5-Methyl-1H-imidazol-1-yl...)
Show SMILES Cc1cncn1CCCN=C(C[N+]([O-])=O)Nc1ccc(Cl)cc1 |w:9.9|
Show InChI InChI=1S/C15H18ClN5O2/c1-12-9-17-11-20(12)8-2-7-18-15(10-21(22)23)19-14-5-3-13(16)4-6-14/h3-6,9,11H,2,7-8,10H2,1H3,(H,18,19)
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51n/a 320n/an/an/an/a8.0n/a



Probiodrug AG

US Patent


Assay Description
All measurements were performed with a BioAssay Reader HTS-7000Plus for microplates (Perkin Elmer) at 30C. QC activity was evaluated fluorometrically...


US Patent US8772508 (2014)


BindingDB Entry DOI: 10.7270/Q2R78CW3
More data for this
Ligand-Target Pair
Glutaminyl-peptide cyclotransferase-like protein


(Homo sapiens (Human))
BDBM124971
PNG
(US8772508, 2)
Show SMILES COc1ccc(N\C(NCCCn2cncc2C)=C\[N+]([O-])=O)c(OC)c1
Show InChI InChI=1S/C17H23N5O4/c1-13-10-18-12-21(13)8-4-7-19-17(11-22(23)24)20-15-6-5-14(25-2)9-16(15)26-3/h5-6,9-10,12H,4,7-8,11H2,1-3H3,(H,19,20)
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55n/a 530n/an/an/an/a8.0n/a



Probiodrug AG

US Patent


Assay Description
All measurements were performed with a BioAssay Reader HTS-7000Plus for microplates (Perkin Elmer) at 30C. QC activity was evaluated fluorometrically...


US Patent US8772508 (2014)


BindingDB Entry DOI: 10.7270/Q2R78CW3
More data for this
Ligand-Target Pair
Glutaminyl-peptide cyclotransferase-like protein


(Homo sapiens (Human))
BDBM124975
PNG
(US8772508, 9)
Show SMILES Cc1cncn1CCCN\C(Nc1ccc2OCOc2c1)=C/[N+]([O-])=O
Show InChI InChI=1S/C16H19N5O4/c1-12-8-17-10-20(12)6-2-5-18-16(9-21(22)23)19-13-3-4-14-15(7-13)25-11-24-14/h3-4,7-8,10H,2,5-6,9,11H2,1H3,(H,18,19)
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US Patent
67n/a 340n/an/an/an/a8.0n/a



Probiodrug AG

US Patent


Assay Description
All measurements were performed with a BioAssay Reader HTS-7000Plus for microplates (Perkin Elmer) at 30C. QC activity was evaluated fluorometrically...


US Patent US8772508 (2014)


BindingDB Entry DOI: 10.7270/Q2R78CW3
More data for this
Ligand-Target Pair
Glutaminyl-peptide cyclotransferase-like protein


(Homo sapiens (Human))
BDBM50299868
PNG
(CHEMBL565908 | N-(1-(3-(5-Methyl-1H-imidazol-1-yl)...)
Show SMILES Cc1cncn1CCCN=C(C[N+]([O-])=O)Nc1ccc2OCCOc2c1 |w:9.9|
Show InChI InChI=1S/C17H21N5O4/c1-13-10-18-12-21(13)6-2-5-19-17(11-22(23)24)20-14-3-4-15-16(9-14)26-8-7-25-15/h3-4,9-10,12H,2,5-8,11H2,1H3,(H,19,20)
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67n/a 460n/an/an/an/a8.0n/a



Probiodrug AG

US Patent


Assay Description
All measurements were performed with a BioAssay Reader HTS-7000Plus for microplates (Perkin Elmer) at 30C. QC activity was evaluated fluorometrically...


US Patent US8772508 (2014)


BindingDB Entry DOI: 10.7270/Q2R78CW3
More data for this
Ligand-Target Pair
Glutaminyl-peptide cyclotransferase-like protein


(Homo sapiens (Human))
BDBM124973
PNG
(US8772508, 4)
Show SMILES COc1ccc(N\C(NCCCn2cncc2C)=C\[N+]([O-])=O)cc1OC
Show InChI InChI=1S/C17H23N5O4/c1-13-10-18-12-21(13)8-4-7-19-17(11-22(23)24)20-14-5-6-15(25-2)16(9-14)26-3/h5-6,9-10,12H,4,7-8,11H2,1-3H3,(H,19,20)
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76n/a 730n/an/an/an/a8.0n/a



Probiodrug AG

US Patent


Assay Description
All measurements were performed with a BioAssay Reader HTS-7000Plus for microplates (Perkin Elmer) at 30C. QC activity was evaluated fluorometrically...


US Patent US8772508 (2014)


BindingDB Entry DOI: 10.7270/Q2R78CW3
More data for this
Ligand-Target Pair
Glutaminyl-peptide cyclotransferase-like protein


(Homo sapiens (Human))
BDBM50299864
PNG
(CHEMBL574357 | N-(1-(3-(5-Methyl-1H-imidazol-1-yl)...)
Show SMILES Cc1cncn1CCCN=C(C[N+]([O-])=O)NC1CCCCC1 |w:9.9|
Show InChI InChI=1S/C15H25N5O2/c1-13-10-16-12-19(13)9-5-8-17-15(11-20(21)22)18-14-6-3-2-4-7-14/h10,12,14H,2-9,11H2,1H3,(H,17,18)
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US Patent
80n/a 340n/an/an/an/a8.0n/a



Probiodrug AG

US Patent


Assay Description
All measurements were performed with a BioAssay Reader HTS-7000Plus for microplates (Perkin Elmer) at 30C. QC activity was evaluated fluorometrically...


US Patent US8772508 (2014)


BindingDB Entry DOI: 10.7270/Q2R78CW3
More data for this
Ligand-Target Pair
Glutaminyl-peptide cyclotransferase-like protein


(Homo sapiens (Human))
BDBM124972
PNG
(US8772508, 3)
Show SMILES COc1cc(N\C(NCCCn2cncc2C)=C\[N+]([O-])=O)cc(OC)c1OC
Show InChI InChI=1S/C18H25N5O5/c1-13-10-19-12-22(13)7-5-6-20-17(11-23(24)25)21-14-8-15(26-2)18(28-4)16(9-14)27-3/h8-10,12H,5-7,11H2,1-4H3,(H,20,21)
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96n/a 620n/an/an/an/a8.0n/a



Probiodrug AG

US Patent


Assay Description
All measurements were performed with a BioAssay Reader HTS-7000Plus for microplates (Perkin Elmer) at 30C. QC activity was evaluated fluorometrically...


US Patent US8772508 (2014)


BindingDB Entry DOI: 10.7270/Q2R78CW3
More data for this
Ligand-Target Pair
Glutaminyl-peptide cyclotransferase-like protein


(Homo sapiens (Human))
BDBM124981
PNG
(US8772508, 18)
Show SMILES Cc1cn(CCCN\C(Nc2cccc3ccccc23)=C/[N+]([O-])=O)cn1
Show InChI InChI=1S/C19H21N5O2/c1-15-12-23(14-21-15)11-5-10-20-19(13-24(25)26)22-18-9-4-7-16-6-2-3-8-17(16)18/h2-4,6-9,12,14H,5,10-11,13H2,1H3,(H,20,22)
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n/an/a 7.46E+3n/an/an/an/a8.0n/a



Probiodrug AG

US Patent


Assay Description
All measurements were performed with a BioAssay Reader HTS-7000Plus for microplates (Perkin Elmer) at 30C. QC activity was evaluated fluorometrically...


US Patent US8772508 (2014)


BindingDB Entry DOI: 10.7270/Q2R78CW3
More data for this
Ligand-Target Pair
Glutaminyl-peptide cyclotransferase-like protein


(Homo sapiens (Human))
BDBM124976
PNG
(US8772508, 11)
Show SMILES Cc1cn(CCCN\C(Nc2ccc(Cl)cc2)=C/[N+]([O-])=O)cn1
Show InChI InChI=1S/C15H18ClN5O2/c1-12-9-20(11-18-12)8-2-7-17-15(10-21(22)23)19-14-5-3-13(16)4-6-14/h3-6,9,11H,2,7-8,10H2,1H3,(H,17,19)
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n/an/a 8.60E+3n/an/an/an/a8.0n/a



Probiodrug AG

US Patent


Assay Description
All measurements were performed with a BioAssay Reader HTS-7000Plus for microplates (Perkin Elmer) at 30C. QC activity was evaluated fluorometrically...


US Patent US8772508 (2014)


BindingDB Entry DOI: 10.7270/Q2R78CW3
More data for this
Ligand-Target Pair
Glutaminyl-peptide cyclotransferase-like protein


(Homo sapiens (Human))
BDBM124977
PNG
(US8772508, 14)
Show SMILES COc1ccc(N\C(NCCCn2cnc(C)c2)=C\[N+]([O-])=O)cc1OC
Show InChI InChI=1S/C17H23N5O4/c1-13-10-21(12-19-13)8-4-7-18-17(11-22(23)24)20-14-5-6-15(25-2)16(9-14)26-3/h5-6,9-10,12H,4,7-8,11H2,1-3H3,(H,18,20)
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n/an/a 8.73E+3n/an/an/an/a8.0n/a



Probiodrug AG

US Patent


Assay Description
All measurements were performed with a BioAssay Reader HTS-7000Plus for microplates (Perkin Elmer) at 30C. QC activity was evaluated fluorometrically...


US Patent US8772508 (2014)


BindingDB Entry DOI: 10.7270/Q2R78CW3
More data for this
Ligand-Target Pair
Glutaminyl-peptide cyclotransferase-like protein


(Homo sapiens (Human))
BDBM50299852
PNG
(CHEMBL568073 | N-(1-(3-(4-Methyl-1H-imidazol-1-yl)...)
Show SMILES Cc1cn(CCCNC(C[N+]([O-])=O)=Nc2ccc3OCCOc3c2)cn1 |w:13.13|
Show InChI InChI=1S/C17H21N5O4/c1-13-10-21(12-19-13)6-2-5-18-17(11-22(23)24)20-14-3-4-15-16(9-14)26-8-7-25-15/h3-4,9-10,12H,2,5-8,11H2,1H3,(H,18,20)
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n/an/a 8.79E+3n/an/an/an/a8.0n/a



Probiodrug AG

US Patent


Assay Description
All measurements were performed with a BioAssay Reader HTS-7000Plus for microplates (Perkin Elmer) at 30C. QC activity was evaluated fluorometrically...


US Patent US8772508 (2014)


BindingDB Entry DOI: 10.7270/Q2R78CW3
More data for this
Ligand-Target Pair
Glutaminyl-peptide cyclotransferase-like protein


(Homo sapiens (Human))
BDBM124979
PNG
(US8772508, 16)
Show SMILES COc1ccc(N\C(NCCCn2cnc(C)c2)=C\[N+]([O-])=O)c(OC)c1
Show InChI InChI=1S/C17H23N5O4/c1-13-10-21(12-19-13)8-4-7-18-17(11-22(23)24)20-15-6-5-14(25-2)9-16(15)26-3/h5-6,9-10,12H,4,7-8,11H2,1-3H3,(H,18,20)
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n/an/a 9.45E+3n/an/an/an/a8.0n/a



Probiodrug AG

US Patent


Assay Description
All measurements were performed with a BioAssay Reader HTS-7000Plus for microplates (Perkin Elmer) at 30C. QC activity was evaluated fluorometrically...


US Patent US8772508 (2014)


BindingDB Entry DOI: 10.7270/Q2R78CW3
More data for this
Ligand-Target Pair
Glutaminyl-peptide cyclotransferase-like protein


(Homo sapiens (Human))
BDBM124978
PNG
(US8772508, 15)
Show SMILES COc1cc(N\C(NCCCn2cnc(C)c2)=C\[N+]([O-])=O)cc(OC)c1OC
Show InChI InChI=1S/C18H25N5O5/c1-13-10-22(12-20-13)7-5-6-19-17(11-23(24)25)21-14-8-15(26-2)18(28-4)16(9-14)27-3/h8-10,12H,5-7,11H2,1-4H3,(H,19,21)
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n/an/a 9.68E+3n/an/an/an/a8.0n/a



Probiodrug AG

US Patent


Assay Description
All measurements were performed with a BioAssay Reader HTS-7000Plus for microplates (Perkin Elmer) at 30C. QC activity was evaluated fluorometrically...


US Patent US8772508 (2014)


BindingDB Entry DOI: 10.7270/Q2R78CW3
More data for this
Ligand-Target Pair
Glutaminyl-peptide cyclotransferase-like protein


(Homo sapiens (Human))
BDBM124980
PNG
(US8772508, 17)
Show SMILES Cc1cn(CCCN\C(Nc2ccc3OCOc3c2)=C/[N+]([O-])=O)cn1
Show InChI InChI=1S/C16H19N5O4/c1-12-8-20(10-18-12)6-2-5-17-16(9-21(22)23)19-13-3-4-14-15(7-13)25-11-24-14/h3-4,7-8,10H,2,5-6,9,11H2,1H3,(H,17,19)
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n/an/a 1.04E+4n/an/an/an/a8.0n/a



Probiodrug AG

US Patent


Assay Description
All measurements were performed with a BioAssay Reader HTS-7000Plus for microplates (Perkin Elmer) at 30C. QC activity was evaluated fluorometrically...


US Patent US8772508 (2014)


BindingDB Entry DOI: 10.7270/Q2R78CW3
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%