BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 264 hits with Last Name = 'niestroj' and Initial = 'a'   
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 Cyclase


(Homo sapiens (Human))
BDBM50299853
PNG
(1-(3,4-Dimethoxyphenyl)-3-(3-(5-methyl-1H-imidazol...)
Show SMILES COc1ccc(NC(=S)NCCCn2cncc2C)cc1OC
Show InChI InChI=1S/C16H22N4O2S/c1-12-10-17-11-20(12)8-4-7-18-16(23)19-13-5-6-14(21-2)15(9-13)22-3/h5-6,9-11H,4,7-8H2,1-3H3,(H2,18,19,23)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

US Patent
6n/an/an/an/an/an/an/an/a



PROBIODRUG AG

US Patent


Assay Description
This novel assay was used to determine the kinetic parameters for most of the QC substrates. QC activity was analyzed spectrophotometrically using a ...


US Patent US9656991 (2017)

More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM309890
PNG
(1-(3,4,5- trimethoxyphenyl)-3- (3-(5-methyl-1H- im...)
Show SMILES COc1cc(NC(=S)NCCCn2cncc2C)cc(OC)c1OC
Show InChI InChI=1S/C17H24N4O3S/c1-12-10-18-11-21(12)7-5-6-19-17(25)20-13-8-14(22-2)16(24-4)15(9-13)23-3/h8-11H,5-7H2,1-4H3,(H2,19,20,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
15n/an/an/an/an/an/an/an/a



PROBIODRUG AG

US Patent


Assay Description
This novel assay was used to determine the kinetic parameters for most of the QC substrates. QC activity was analyzed spectrophotometrically using a ...


US Patent US9656991 (2017)

More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM309891
PNG
(1-(3,5- dimethoxyphenyl)-3- (3-(5-methyl-1H- imida...)
Show SMILES COc1cc(NC(=S)NCCCn2cncc2C)cc(OC)c1
Show InChI InChI=1S/C16H22N4O2S/c1-12-10-17-11-20(12)6-4-5-18-16(23)19-13-7-14(21-2)9-15(8-13)22-3/h7-11H,4-6H2,1-3H3,(H2,18,19,23)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
24n/an/an/an/an/an/an/an/a



PROBIODRUG AG

US Patent


Assay Description
This novel assay was used to determine the kinetic parameters for most of the QC substrates. QC activity was analyzed spectrophotometrically using a ...


US Patent US9656991 (2017)

More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM309919
PNG
(1-(4- (benzyloxy)phenyl)- 3-(3-(5-methyl-1H- imida...)
Show SMILES Cc1cncn1CCCNC(=S)Nc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C21H24N4OS/c1-17-14-22-16-25(17)13-5-12-23-21(27)24-19-8-10-20(11-9-19)26-15-18-6-3-2-4-7-18/h2-4,6-11,14,16H,5,12-13,15H2,1H3,(H2,23,24,27)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
25n/an/an/an/an/an/an/an/a



PROBIODRUG AG

US Patent


Assay Description
This novel assay was used to determine the kinetic parameters for most of the QC substrates. QC activity was analyzed spectrophotometrically using a ...


US Patent US9656991 (2017)

More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM309917
PNG
(1-(3,4- dimethoxyphenyl)-3- (4-(5-methyl-1H- imida...)
Show SMILES COc1ccc(NC(=S)NCCCCn2cncc2C)cc1OC
Show InChI InChI=1S/C17H24N4O2S/c1-13-11-18-12-21(13)9-5-4-8-19-17(24)20-14-6-7-15(22-2)16(10-14)23-3/h6-7,10-12H,4-5,8-9H2,1-3H3,(H2,19,20,24)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
27n/an/an/an/an/an/an/an/a



PROBIODRUG AG

US Patent


Assay Description
This novel assay was used to determine the kinetic parameters for most of the QC substrates. QC activity was analyzed spectrophotometrically using a ...


US Patent US9656991 (2017)

More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM309892
PNG
(1-(2,4- dimethoxyphenyl)-3- (3-(5-methyl-1H- imida...)
Show SMILES COc1ccc(NC(=S)NCCCn2cncc2C)c(OC)c1
Show InChI InChI=1S/C16H22N4O2S/c1-12-10-17-11-20(12)8-4-7-18-16(23)19-14-6-5-13(21-2)9-15(14)22-3/h5-6,9-11H,4,7-8H2,1-3H3,(H2,18,19,23)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
28n/an/an/an/an/an/an/an/a



PROBIODRUG AG

US Patent


Assay Description
This novel assay was used to determine the kinetic parameters for most of the QC substrates. QC activity was analyzed spectrophotometrically using a ...


US Patent US9656991 (2017)

More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM309935
PNG
(1-(3,4- dimethoxybenzyl)-3- (1H- benzo[d]imidazol-...)
Show SMILES COc1ccc(CNC(=S)Nc2ccc3[nH]cnc3c2)cc1OC
Show InChI InChI=1S/C17H18N4O2S/c1-22-15-6-3-11(7-16(15)23-2)9-18-17(24)21-12-4-5-13-14(8-12)20-10-19-13/h3-8,10H,9H2,1-2H3,(H,19,20)(H2,18,21,24)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
29n/an/an/an/an/an/an/an/a



PROBIODRUG AG

US Patent


Assay Description
This novel assay was used to determine the kinetic parameters for most of the QC substrates. QC activity was analyzed spectrophotometrically using a ...


US Patent US9656991 (2017)

More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM258436
PNG
(US9512082, 1)
Show SMILES COc1ccc(NC(=O)NCCCn2cncc2C)cc1OC
Show InChI InChI=1S/C16H22N4O3/c1-12-10-17-11-20(12)8-4-7-18-16(21)19-13-5-6-14(22-2)15(9-13)23-3/h5-6,9-11H,4,7-8H2,1-3H3,(H2,18,19,21)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
31.2 -43.6 192n/an/an/an/a8.030



PROBIODRUG AG

US Patent


Assay Description
For inhibitor testing, the sample composition was the same as described below, except of the putative inhibitory compound added. For a rapid test of ...


US Patent US9512082 (2016)


BindingDB Entry DOI: 10.7270/Q2CR5S92
More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM309889
PNG
(1-(4-ethoxyphenyl)- 3-(3-(5-methyl-1H- imidazol-1-...)
Show SMILES CCOc1ccc(NC(=S)NCCCn2cncc2C)cc1
Show InChI InChI=1S/C16H22N4OS/c1-3-21-15-7-5-14(6-8-15)19-16(22)18-9-4-10-20-12-17-11-13(20)2/h5-8,11-12H,3-4,9-10H2,1-2H3,(H2,18,19,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
32n/an/an/an/an/an/an/an/a



PROBIODRUG AG

US Patent


Assay Description
This novel assay was used to determine the kinetic parameters for most of the QC substrates. QC activity was analyzed spectrophotometrically using a ...


US Patent US9656991 (2017)

More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM309893
PNG
(1-(4- methoxyphenyl)-3- (3-(5-methyl-1H- imidazol-...)
Show SMILES COc1ccc(NC(=S)NCCCn2cncc2C)cc1
Show InChI InChI=1S/C15H20N4OS/c1-12-10-16-11-19(12)9-3-8-17-15(21)18-13-4-6-14(20-2)7-5-13/h4-7,10-11H,3,8-9H2,1-2H3,(H2,17,18,21)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
32n/an/an/an/an/an/an/an/a



PROBIODRUG AG

US Patent


Assay Description
This novel assay was used to determine the kinetic parameters for most of the QC substrates. QC activity was analyzed spectrophotometrically using a ...


US Patent US9656991 (2017)

More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM309888
PNG
(1-(3-(5-methyl-1H- imidazol-1- yl)propyl)-3-(4- (o...)
Show SMILES Cc1cncn1CCCNC(=S)Nc1ccc(cc1)-c1cnco1
Show InChI InChI=1S/C17H19N5OS/c1-13-9-18-11-22(13)8-2-7-20-17(24)21-15-5-3-14(4-6-15)16-10-19-12-23-16/h3-6,9-12H,2,7-8H2,1H3,(H2,20,21,24)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
35n/an/an/an/an/an/an/an/a



PROBIODRUG AG

US Patent


Assay Description
This novel assay was used to determine the kinetic parameters for most of the QC substrates. QC activity was analyzed spectrophotometrically using a ...


US Patent US9656991 (2017)

More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM309918
PNG
(1-mesityl-3-(3-(5- methyl-1H-imidazol- 1-yl)propyl...)
Show SMILES Cc1cncn1CCCNC(=S)Nc1c(C)cc(C)cc1C
Show InChI InChI=1S/C17H24N4S/c1-12-8-13(2)16(14(3)9-12)20-17(22)19-6-5-7-21-11-18-10-15(21)4/h8-11H,5-7H2,1-4H3,(H2,19,20,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
41n/an/an/an/an/an/an/an/a



PROBIODRUG AG

US Patent


Assay Description
This novel assay was used to determine the kinetic parameters for most of the QC substrates. QC activity was analyzed spectrophotometrically using a ...


US Patent US9656991 (2017)

More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM258437
PNG
(US9512082, 2)
Show SMILES COc1ccc(NC(=O)NCCCn2cncc2C)cc1OC1CCCC1
Show InChI InChI=1S/C20H28N4O3/c1-15-13-21-14-24(15)11-5-10-22-20(25)23-16-8-9-18(26-2)19(12-16)27-17-6-3-4-7-17/h8-9,12-14,17H,3-7,10-11H2,1-2H3,(H2,22,23,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
60 -41.9 343n/an/an/an/a8.030



PROBIODRUG AG

US Patent


Assay Description
For inhibitor testing, the sample composition was the same as described below, except of the putative inhibitory compound added. For a rapid test of ...


US Patent US9512082 (2016)


BindingDB Entry DOI: 10.7270/Q2CR5S92
More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM50299849
PNG
(1-(3,4-Dimethoxyphenyl)-3-(3-(4-methyl-1H-imidazol...)
Show SMILES COc1ccc(NC(=S)NCCCn2cnc(C)c2)cc1OC
Show InChI InChI=1S/C16H22N4O2S/c1-12-10-20(11-18-12)8-4-7-17-16(23)19-13-5-6-14(21-2)15(9-13)22-3/h5-6,9-11H,4,7-8H2,1-3H3,(H2,17,19,23)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

US Patent
60n/an/an/an/an/an/an/an/a



PROBIODRUG AG

US Patent


Assay Description
This novel assay was used to determine the kinetic parameters for most of the QC substrates. QC activity was analyzed spectrophotometrically using a ...


US Patent US9656991 (2017)

More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM7918
PNG
(1-(3,4-dimethoxyphenyl)-3-[3-(1H-imidazol-1-yl)pro...)
Show SMILES COc1ccc(NC(=S)NCCCn2ccnc2)cc1OC
Show InChI InChI=1S/C15H20N4O2S/c1-20-13-5-4-12(10-14(13)21-2)18-15(22)17-6-3-8-19-9-7-16-11-19/h4-5,7,9-11H,3,6,8H2,1-2H3,(H2,17,18,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

PDB
Article
PubMed
60n/an/an/an/an/an/an/an/a



Probiodrug AG



Assay Description
QC activity was evaluated fluorometrically using Gln-AMC as substrate, and pyroglutamyl peptidase as the auxiliary enzyme. After conversion of Gln-AM...


J Med Chem 49: 664-77 (2006)


Article DOI: 10.1021/jm050756e
BindingDB Entry DOI: 10.7270/Q28S4N46
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM7937
PNG
(1-(3,4-dimethoxyphenyl)-N-[3-(1H-imidazol-1-yl)pro...)
Show SMILES COc1ccc(cc1OC)C1(CC1)C(=S)NCCCn1ccnc1
Show InChI InChI=1S/C18H23N3O2S/c1-22-15-5-4-14(12-16(15)23-2)18(6-7-18)17(24)20-8-3-10-21-11-9-19-13-21/h4-5,9,11-13H,3,6-8,10H2,1-2H3,(H,20,24)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
90n/an/an/an/an/an/an/an/a



Probiodrug AG



Assay Description
QC activity was evaluated fluorometrically using Gln-AMC as substrate, and pyroglutamyl peptidase as the auxiliary enzyme. After conversion of Gln-AM...


J Med Chem 49: 664-77 (2006)


Article DOI: 10.1021/jm050756e
BindingDB Entry DOI: 10.7270/Q28S4N46
More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM309942
PNG
(1-(2,4- dimethoxybenzyl)-3- (1H- benzo[d]imidazol-...)
Show SMILES COc1ccc(CNC(=S)Nc2ccc3[nH]cnc3c2)c(OC)c1
Show InChI InChI=1S/C17H18N4O2S/c1-22-13-5-3-11(16(8-13)23-2)9-18-17(24)21-12-4-6-14-15(7-12)20-10-19-14/h3-8,10H,9H2,1-2H3,(H,19,20)(H2,18,21,24)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
108n/an/an/an/an/an/an/an/a



PROBIODRUG AG

US Patent


Assay Description
This novel assay was used to determine the kinetic parameters for most of the QC substrates. QC activity was analyzed spectrophotometrically using a ...


US Patent US9656991 (2017)

More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM309943
PNG
(1-(4-hydroxy-3- methoxybenzyl)-3- (1H- benzo[d]imi...)
Show SMILES COc1cc(CNC(=S)Nc2ccc3[nH]cnc3c2)ccc1O
Show InChI InChI=1S/C16H16N4O2S/c1-22-15-6-10(2-5-14(15)21)8-17-16(23)20-11-3-4-12-13(7-11)19-9-18-12/h2-7,9,21H,8H2,1H3,(H,18,19)(H2,17,20,23)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
110n/an/an/an/an/an/an/an/a



PROBIODRUG AG

US Patent


Assay Description
This novel assay was used to determine the kinetic parameters for most of the QC substrates. QC activity was analyzed spectrophotometrically using a ...


US Patent US9656991 (2017)

More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM309949
PNG
(1-(3-chloro-4- methoxybenzyl)-3- (1H- benzo[d]imid...)
Show SMILES COc1ccc(CNC(=S)Nc2ccc3[nH]cnc3c2)cc1Cl
Show InChI InChI=1S/C16H15ClN4OS/c1-22-15-5-2-10(6-12(15)17)8-18-16(23)21-11-3-4-13-14(7-11)20-9-19-13/h2-7,9H,8H2,1H3,(H,19,20)(H2,18,21,23)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
120n/an/an/an/an/an/an/an/a



PROBIODRUG AG

US Patent


Assay Description
This novel assay was used to determine the kinetic parameters for most of the QC substrates. QC activity was analyzed spectrophotometrically using a ...


US Patent US9656991 (2017)

More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM309938
PNG
(1-(3,4,5-trimethoxy- benzyl)-3-(1H- benzo[d]imidaz...)
Show SMILES COc1cc(CNC(=S)Nc2ccc3[nH]cnc3c2)cc(OC)c1OC
Show InChI InChI=1S/C18H20N4O3S/c1-23-15-6-11(7-16(24-2)17(15)25-3)9-19-18(26)22-12-4-5-13-14(8-12)21-10-20-13/h4-8,10H,9H2,1-3H3,(H,20,21)(H2,19,22,26)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
166n/an/an/an/an/an/an/an/a



PROBIODRUG AG

US Patent


Assay Description
This novel assay was used to determine the kinetic parameters for most of the QC substrates. QC activity was analyzed spectrophotometrically using a ...


US Patent US9656991 (2017)

More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM309937
PNG
(1-(1H-benzo[d]- imidazol-5-yl)-3- ((R)-1-(4- metho...)
Show SMILES COc1ccc(cc1)C(C)NC(=S)Nc1ccc2[nH]cnc2c1
Show InChI InChI=1S/C17H18N4OS/c1-11(12-3-6-14(22-2)7-4-12)20-17(23)21-13-5-8-15-16(9-13)19-10-18-15/h3-11H,1-2H3,(H,18,19)(H2,20,21,23)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
166n/an/an/an/an/an/an/an/a



PROBIODRUG AG

US Patent


Assay Description
This novel assay was used to determine the kinetic parameters for most of the QC substrates. QC activity was analyzed spectrophotometrically using a ...


US Patent US9656991 (2017)

More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM258442
PNG
(US9512082, 7)
Show SMILES COc1ccc(CNC(=O)Nc2ccc3[nH]cnc3c2)cc1OC
Show InChI InChI=1S/C17H18N4O3/c1-23-15-6-3-11(7-16(15)24-2)9-18-17(22)21-12-4-5-13-14(8-12)20-10-19-13/h3-8,10H,9H2,1-2H3,(H,19,20)(H2,18,21,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
171 -39.3 1.67E+3n/an/an/an/a8.030



PROBIODRUG AG

US Patent


Assay Description
For inhibitor testing, the sample composition was the same as described below, except of the putative inhibitory compound added. For a rapid test of ...


US Patent US9512082 (2016)


BindingDB Entry DOI: 10.7270/Q2CR5S92
More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM309924
PNG
(1-(3,4,5- trimethoxyphenyl)-3- (3-(4-methyl-1H- im...)
Show SMILES COc1cc(NC(=S)NCCCn2cnc(C)c2)cc(OC)c1OC
Show InChI InChI=1S/C17H24N4O3S/c1-12-10-21(11-19-12)7-5-6-18-17(25)20-13-8-14(22-2)16(24-4)15(9-13)23-3/h8-11H,5-7H2,1-4H3,(H2,18,20,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
258n/an/an/an/an/an/an/an/a



PROBIODRUG AG

US Patent


Assay Description
This novel assay was used to determine the kinetic parameters for most of the QC substrates. QC activity was analyzed spectrophotometrically using a ...


US Patent US9656991 (2017)

More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM309898
PNG
(1-(4- methoxybenzyl)-3- (1H- benzo[d]imidazol-5- y...)
Show SMILES COc1ccc(CNC(=S)Nc2ccc3[nH]cnc3c2)cc1
Show InChI InChI=1S/C16H16N4OS/c1-21-13-5-2-11(3-6-13)9-17-16(22)20-12-4-7-14-15(8-12)19-10-18-14/h2-8,10H,9H2,1H3,(H,18,19)(H2,17,20,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
264n/an/an/an/an/an/an/an/a



PROBIODRUG AG

US Patent


Assay Description
This novel assay was used to determine the kinetic parameters for most of the QC substrates. QC activity was analyzed spectrophotometrically using a ...


US Patent US9656991 (2017)

More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM309921
PNG
(1-(4- (benzyloxy)phenyl)- 3-(3-(4-methyl-1H- imida...)
Show SMILES Cc1cn(CCCNC(=S)Nc2ccc(OCc3ccccc3)cc2)cn1
Show InChI InChI=1S/C21H24N4OS/c1-17-14-25(16-23-17)13-5-12-22-21(27)24-19-8-10-20(11-9-19)26-15-18-6-3-2-4-7-18/h2-4,6-11,14,16H,5,12-13,15H2,1H3,(H2,22,24,27)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
272n/an/an/an/an/an/an/an/a



PROBIODRUG AG

US Patent


Assay Description
This novel assay was used to determine the kinetic parameters for most of the QC substrates. QC activity was analyzed spectrophotometrically using a ...


US Patent US9656991 (2017)

More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM309944
PNG
(1-(3-hydroxy-4- methoxybenzyl)-3- (1H- benzo[d]imi...)
Show SMILES COc1ccc(CNC(=S)Nc2ccc3[nH]cnc3c2)cc1O
Show InChI InChI=1S/C16H16N4O2S/c1-22-15-5-2-10(6-14(15)21)8-17-16(23)20-11-3-4-12-13(7-11)19-9-18-12/h2-7,9,21H,8H2,1H3,(H,18,19)(H2,17,20,23)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
290n/an/an/an/an/an/an/an/a



PROBIODRUG AG

US Patent


Assay Description
This novel assay was used to determine the kinetic parameters for most of the QC substrates. QC activity was analyzed spectrophotometrically using a ...


US Patent US9656991 (2017)

More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM7965
PNG
(1,4-bis-(imidazol-1-yl)methyl-2,5-dimethylbenzene ...)
Show SMILES Cc1cc(Cn2ccnc2)c(C)cc1Cn1ccnc1
Show InChI InChI=1S/C16H18N4/c1-13-7-16(10-20-6-4-18-12-20)14(2)8-15(13)9-19-5-3-17-11-19/h3-8,11-12H,9-10H2,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

Article
PubMed
295n/an/an/an/an/an/an/an/a



Probiodrug AG



Assay Description
QC activity was evaluated fluorometrically using Gln-AMC as substrate, and pyroglutamyl peptidase as the auxiliary enzyme. After conversion of Gln-AM...


J Biol Chem 278: 49773-9 (2003)


Article DOI: 10.1074/jbc.M309077200
BindingDB Entry DOI: 10.7270/Q2513WDS
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM7921
PNG
(1-((R)-3-(1H-Imidazol-1-yl)-2-methylpropyl)-3-(3,4...)
Show SMILES COc1ccc(NC(=S)NC[C@@H](C)Cn2ccnc2)cc1OC
Show InChI InChI=1S/C16H22N4O2S/c1-12(10-20-7-6-17-11-20)9-18-16(23)19-13-4-5-14(21-2)15(8-13)22-3/h4-8,11-12H,9-10H2,1-3H3,(H2,18,19,23)/t12-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
340n/an/an/an/an/an/an/an/a



Probiodrug AG



Assay Description
QC activity was evaluated fluorometrically using Gln-AMC as substrate, and pyroglutamyl peptidase as the auxiliary enzyme. After conversion of Gln-AM...


J Med Chem 49: 664-77 (2006)


Article DOI: 10.1021/jm050756e
BindingDB Entry DOI: 10.7270/Q28S4N46
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM7917
PNG
(1-(3-(1H-Imidazol-1-yl)propyl)-3-(3,4,5-trimethoxy...)
Show SMILES COc1cc(NC(=S)NCCCn2ccnc2)cc(OC)c1OC
Show InChI InChI=1S/C16H22N4O3S/c1-21-13-9-12(10-14(22-2)15(13)23-3)19-16(24)18-5-4-7-20-8-6-17-11-20/h6,8-11H,4-5,7H2,1-3H3,(H2,18,19,24)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
340n/an/an/an/an/an/an/an/a



Probiodrug AG



Assay Description
QC activity was evaluated fluorometrically using Gln-AMC as substrate, and pyroglutamyl peptidase as the auxiliary enzyme. After conversion of Gln-AM...


J Med Chem 49: 664-77 (2006)


Article DOI: 10.1021/jm050756e
BindingDB Entry DOI: 10.7270/Q28S4N46
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM7929
PNG
(2-(3,4-dimethoxyphenyl)-N-[3-(1H-imidazol-1-yl)pro...)
Show SMILES COc1ccc(CC(=S)NCCCn2ccnc2)cc1OC
Show InChI InChI=1S/C16H21N3O2S/c1-20-14-5-4-13(10-15(14)21-2)11-16(22)18-6-3-8-19-9-7-17-12-19/h4-5,7,9-10,12H,3,6,8,11H2,1-2H3,(H,18,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
390n/an/an/an/an/an/an/an/a



Probiodrug AG



Assay Description
QC activity was evaluated fluorometrically using Gln-AMC as substrate, and pyroglutamyl peptidase as the auxiliary enzyme. After conversion of Gln-AM...


J Med Chem 49: 664-77 (2006)


Article DOI: 10.1021/jm050756e
BindingDB Entry DOI: 10.7270/Q28S4N46
More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM7933
PNG
(N-(3-(1H-Imidazol-1-yl)propyl)-1-(4-methoxyphenyl)...)
Show SMILES COc1ccc(cc1)C1(CC1)C(=S)NCCCn1ccnc1
Show InChI InChI=1S/C17H21N3OS/c1-21-15-5-3-14(4-6-15)17(7-8-17)16(22)19-9-2-11-20-12-10-18-13-20/h3-6,10,12-13H,2,7-9,11H2,1H3,(H,19,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
400n/an/an/an/an/an/an/an/a



Probiodrug AG



Assay Description
QC activity was evaluated fluorometrically using Gln-AMC as substrate, and pyroglutamyl peptidase as the auxiliary enzyme. After conversion of Gln-AM...


J Med Chem 49: 664-77 (2006)


Article DOI: 10.1021/jm050756e
BindingDB Entry DOI: 10.7270/Q28S4N46
More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM309922
PNG
(1-mesityl-3-(3-(4- methyl-1H-imidazol- 1-yl)propyl...)
Show SMILES Cc1cn(CCCNC(=S)Nc2c(C)cc(C)cc2C)cn1
Show InChI InChI=1S/C17H24N4S/c1-12-8-13(2)16(14(3)9-12)20-17(22)18-6-5-7-21-10-15(4)19-11-21/h8-11H,5-7H2,1-4H3,(H2,18,20,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
412n/an/an/an/an/an/an/an/a



PROBIODRUG AG

US Patent


Assay Description
This novel assay was used to determine the kinetic parameters for most of the QC substrates. QC activity was analyzed spectrophotometrically using a ...


US Patent US9656991 (2017)

More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM309939
PNG
(1-(3- methoxybenzyl)-3- (1H-benzo[d]- imidazol-5- ...)
Show SMILES COc1cccc(CNC(=S)Nc2ccc3[nH]cnc3c2)c1
Show InChI InChI=1S/C16H16N4OS/c1-21-13-4-2-3-11(7-13)9-17-16(22)20-12-5-6-14-15(8-12)19-10-18-14/h2-8,10H,9H2,1H3,(H,18,19)(H2,17,20,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
426n/an/an/an/an/an/an/an/a



PROBIODRUG AG

US Patent


Assay Description
This novel assay was used to determine the kinetic parameters for most of the QC substrates. QC activity was analyzed spectrophotometrically using a ...


US Patent US9656991 (2017)

More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM258441
PNG
(US9512082, 6)
Show SMILES COc1ccc(NC(=O)NCc2ccc3nc[nH]c3c2)cc1OC
Show InChI InChI=1S/C17H18N4O3/c1-23-15-6-4-12(8-16(15)24-2)21-17(22)18-9-11-3-5-13-14(7-11)20-10-19-13/h3-8,10H,9H2,1-2H3,(H,19,20)(H2,18,21,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
458 -36.8 4.25E+3n/an/an/an/a8.030



PROBIODRUG AG

US Patent


Assay Description
For inhibitor testing, the sample composition was the same as described below, except of the putative inhibitory compound added. For a rapid test of ...


US Patent US9512082 (2016)


BindingDB Entry DOI: 10.7270/Q2CR5S92
More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM7916
PNG
(1-(3,4-dimethoxyphenyl)-3-[3-(1H-imidazol-1-yl)pro...)
Show SMILES COc1ccc(NC(=O)NCCCn2ccnc2)cc1OC
Show InChI InChI=1S/C15H20N4O3/c1-21-13-5-4-12(10-14(13)22-2)18-15(20)17-6-3-8-19-9-7-16-11-19/h4-5,7,9-11H,3,6,8H2,1-2H3,(H2,17,18,20)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
Article
PubMed
490n/an/an/an/an/an/an/an/a



Probiodrug AG



Assay Description
QC activity was evaluated fluorometrically using Gln-AMC as substrate, and pyroglutamyl peptidase as the auxiliary enzyme. After conversion of Gln-AM...


J Med Chem 49: 664-77 (2006)


Article DOI: 10.1021/jm050756e
BindingDB Entry DOI: 10.7270/Q28S4N46
More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM309925
PNG
(1-(3,5- dimethoxyphenyl)-3- (3-(4-methyl-1H- imida...)
Show SMILES COc1cc(NC(=S)NCCCn2cnc(C)c2)cc(OC)c1
Show InChI InChI=1S/C16H22N4O2S/c1-12-10-20(11-18-12)6-4-5-17-16(23)19-13-7-14(21-2)9-15(8-13)22-3/h7-11H,4-6H2,1-3H3,(H2,17,19,23)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
496n/an/an/an/an/an/an/an/a



PROBIODRUG AG

US Patent


Assay Description
This novel assay was used to determine the kinetic parameters for most of the QC substrates. QC activity was analyzed spectrophotometrically using a ...


US Patent US9656991 (2017)

More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM309926
PNG
(1-(2,4- dimethoxyphenyl)-3- (3-(4-methyl-1H- imida...)
Show SMILES COc1ccc(NC(=S)NCCCn2cnc(C)c2)c(OC)c1
Show InChI InChI=1S/C16H22N4O2S/c1-12-10-20(11-18-12)8-4-7-17-16(23)19-14-6-5-13(21-2)9-15(14)22-3/h5-6,9-11H,4,7-8H2,1-3H3,(H2,17,19,23)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
513n/an/an/an/an/an/an/an/a



PROBIODRUG AG

US Patent


Assay Description
This novel assay was used to determine the kinetic parameters for most of the QC substrates. QC activity was analyzed spectrophotometrically using a ...


US Patent US9656991 (2017)

More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM309895
PNG
(1- ((benzo[d][1,3]dioxol- 5-yl)methyl)-3-(1H- benz...)
Show SMILES S=C(NCc1ccc2OCOc2c1)Nc1ccc2[nH]cnc2c1
Show InChI InChI=1S/C16H14N4O2S/c23-16(20-11-2-3-12-13(6-11)19-8-18-12)17-7-10-1-4-14-15(5-10)22-9-21-14/h1-6,8H,7,9H2,(H,18,19)(H2,17,20,23)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
544n/an/an/an/an/an/an/an/a



PROBIODRUG AG

US Patent


Assay Description
This novel assay was used to determine the kinetic parameters for most of the QC substrates. QC activity was analyzed spectrophotometrically using a ...


US Patent US9656991 (2017)

More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM179611
PNG
(US9126987, 14)
Show SMILES Fc1c(F)c(F)c(CSc2nnc(o2)-c2ccc3[nH]cnc3c2)c(F)c1F
Show InChI InChI=1S/C16H7F5N4OS/c17-10-7(11(18)13(20)14(21)12(10)19)4-27-16-25-24-15(26-16)6-1-2-8-9(3-6)23-5-22-8/h1-3,5H,4H2,(H,22,23)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
550 -36.3 2.05E+3n/an/an/an/a8.030



PROBIODRUG AG

US Patent


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


US Patent US9126987 (2015)


BindingDB Entry DOI: 10.7270/Q2N878KV
More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM7920
PNG
(1-(3,4-dimethoxyphenyl)-3-[4-(1H-imidazol-1-yl)but...)
Show SMILES COc1ccc(NC(=S)NCCCCn2ccnc2)cc1OC
Show InChI InChI=1S/C16H22N4O2S/c1-21-14-6-5-13(11-15(14)22-2)19-16(23)18-7-3-4-9-20-10-8-17-12-20/h5-6,8,10-12H,3-4,7,9H2,1-2H3,(H2,18,19,23)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
550n/an/an/an/an/an/an/an/a



Probiodrug AG



Assay Description
QC activity was evaluated fluorometrically using Gln-AMC as substrate, and pyroglutamyl peptidase as the auxiliary enzyme. After conversion of Gln-AM...


J Med Chem 49: 664-77 (2006)


Article DOI: 10.1021/jm050756e
BindingDB Entry DOI: 10.7270/Q28S4N46
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM7915
PNG
(1-(2,4-dimethoxyphenyl)-3-[3-(1H-imidazol-1-yl)pro...)
Show SMILES COc1ccc(NC(=S)NCCCn2ccnc2)c(OC)c1
Show InChI InChI=1S/C15H20N4O2S/c1-20-12-4-5-13(14(10-12)21-2)18-15(22)17-6-3-8-19-9-7-16-11-19/h4-5,7,9-11H,3,6,8H2,1-2H3,(H2,17,18,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
560n/an/an/an/an/an/an/an/a



Probiodrug AG



Assay Description
QC activity was evaluated fluorometrically using Gln-AMC as substrate, and pyroglutamyl peptidase as the auxiliary enzyme. After conversion of Gln-AM...


J Med Chem 49: 664-77 (2006)


Article DOI: 10.1021/jm050756e
BindingDB Entry DOI: 10.7270/Q28S4N46
More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM179606
PNG
(US9126987, 5)
Show SMILES C(Sc1nnc(o1)-c1ccc2[nH]cnc2c1)c1ccc2ccccc2c1
Show InChI InChI=1S/C20H14N4OS/c1-2-4-15-9-13(5-6-14(15)3-1)11-26-20-24-23-19(25-20)16-7-8-17-18(10-16)22-12-21-17/h1-10,12H,11H2,(H,21,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
690 -35.8 8.67E+3n/an/an/an/a8.030



PROBIODRUG AG

US Patent


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


US Patent US9126987 (2015)


BindingDB Entry DOI: 10.7270/Q2N878KV
More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM179614
PNG
(US9126987, 17)
Show SMILES COc1cc(CSc2nnc(o2)-c2ccc3[nH]cnc3c2)cc(OC)c1OC
Show InChI InChI=1S/C19H18N4O4S/c1-24-15-6-11(7-16(25-2)17(15)26-3)9-28-19-23-22-18(27-19)12-4-5-13-14(8-12)21-10-20-13/h4-8,10H,9H2,1-3H3,(H,20,21)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
690 -35.8 1.53E+4n/an/an/an/a8.030



PROBIODRUG AG

US Patent


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


US Patent US9126987 (2015)


BindingDB Entry DOI: 10.7270/Q2N878KV
More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM309930
PNG
(1-(2,4- dichlorobenzyl)-3- (1H-benzo[d]- imidazol-...)
Show SMILES Clc1ccc(CNC(=S)Nc2ccc3[nH]cnc3c2)c(Cl)c1
Show InChI InChI=1S/C15H12Cl2N4S/c16-10-2-1-9(12(17)5-10)7-18-15(22)21-11-3-4-13-14(6-11)20-8-19-13/h1-6,8H,7H2,(H,19,20)(H2,18,21,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
699n/an/an/an/an/an/an/an/a



PROBIODRUG AG

US Patent


Assay Description
This novel assay was used to determine the kinetic parameters for most of the QC substrates. QC activity was analyzed spectrophotometrically using a ...


US Patent US9656991 (2017)

More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM7890
PNG
(1-alkylimidazole deriv. 3 | 3-[3-(1H-imidazol-1-yl...)
Show SMILES Oc1c[nH]c(=S)n1CCCn1ccnc1
Show InChI InChI=1S/C9H12N4OS/c14-8-6-11-9(15)13(8)4-1-3-12-5-2-10-7-12/h2,5-7,14H,1,3-4H2,(H,11,15)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Patents

Article
PubMed
700 -35.7n/an/an/an/an/a8.030



Probiodrug AG



Assay Description
QC activity was evaluated fluorometrically using Gln-AMC as substrate, and pyroglutamyl peptidase as the auxiliary enzyme. After conversion of Gln-AM...


J Med Chem 49: 664-77 (2006)


Article DOI: 10.1021/jm050756e
BindingDB Entry DOI: 10.7270/Q28S4N46
More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM7909
PNG
(1-(3-(1H-Imidazol-1-yl)propyl)-3-(4-methoxyphenyl)...)
Show SMILES COc1ccc(NC(=S)NCCCn2ccnc2)cc1
Show InChI InChI=1S/C14H18N4OS/c1-19-13-5-3-12(4-6-13)17-14(20)16-7-2-9-18-10-8-15-11-18/h3-6,8,10-11H,2,7,9H2,1H3,(H2,16,17,20)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

Article
PubMed
700n/an/an/an/an/an/an/an/a



Probiodrug AG



Assay Description
QC activity was evaluated fluorometrically using Gln-AMC as substrate, and pyroglutamyl peptidase as the auxiliary enzyme. After conversion of Gln-AM...


J Med Chem 49: 664-77 (2006)


Article DOI: 10.1021/jm050756e
BindingDB Entry DOI: 10.7270/Q28S4N46
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM309928
PNG
(1-(3,4- dichlorobenzyl)-3- (1H-benzo[d]- imidazol-...)
Show SMILES Clc1ccc(CNC(=S)Nc2ccc3[nH]cnc3c2)cc1Cl
Show InChI InChI=1S/C15H12Cl2N4S/c16-11-3-1-9(5-12(11)17)7-18-15(22)21-10-2-4-13-14(6-10)20-8-19-13/h1-6,8H,7H2,(H,19,20)(H2,18,21,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
722n/an/an/an/an/an/an/an/a



PROBIODRUG AG

US Patent


Assay Description
This novel assay was used to determine the kinetic parameters for most of the QC substrates. QC activity was analyzed spectrophotometrically using a ...


US Patent US9656991 (2017)

More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM179612
PNG
(US9126987, 15)
Show SMILES Cc1cc(C)c(CSc2nnc(o2)-c2ccc3[nH]cnc3c2)c(C)c1
Show InChI InChI=1S/C19H18N4OS/c1-11-6-12(2)15(13(3)7-11)9-25-19-23-22-18(24-19)14-4-5-16-17(8-14)21-10-20-16/h4-8,10H,9H2,1-3H3,(H,20,21)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
740 -35.6 7.30E+3n/an/an/an/a8.030



PROBIODRUG AG

US Patent


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


US Patent US9126987 (2015)


BindingDB Entry DOI: 10.7270/Q2N878KV
More data for this
Ligand-Target Pair
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM7914
PNG
(1-(3,5-dimethoxyphenyl)-3-[3-(1H-imidazol-1-yl)pro...)
Show SMILES COc1cc(NC(=S)NCCCn2ccnc2)cc(OC)c1
Show InChI InChI=1S/C15H20N4O2S/c1-20-13-8-12(9-14(10-13)21-2)18-15(22)17-4-3-6-19-7-5-16-11-19/h5,7-11H,3-4,6H2,1-2H3,(H2,17,18,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
750n/an/an/an/an/an/an/an/a



Probiodrug AG



Assay Description
QC activity was evaluated fluorometrically using Gln-AMC as substrate, and pyroglutamyl peptidase as the auxiliary enzyme. After conversion of Gln-AM...


J Med Chem 49: 664-77 (2006)


Article DOI: 10.1021/jm050756e
BindingDB Entry DOI: 10.7270/Q28S4N46
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM7922
PNG
(1-((S)-3-(1H-Imidazol-1-yl)-2-methylpropyl)-3-(3,4...)
Show SMILES COc1ccc(NC(=S)NC[C@H](C)Cn2ccnc2)cc1OC
Show InChI InChI=1S/C16H22N4O2S/c1-12(10-20-7-6-17-11-20)9-18-16(23)19-13-4-5-14(21-2)15(8-13)22-3/h4-8,11-12H,9-10H2,1-3H3,(H2,18,19,23)/t12-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
760n/an/an/an/an/an/an/an/a



Probiodrug AG



Assay Description
QC activity was evaluated fluorometrically using Gln-AMC as substrate, and pyroglutamyl peptidase as the auxiliary enzyme. After conversion of Gln-AM...


J Med Chem 49: 664-77 (2006)


Article DOI: 10.1021/jm050756e
BindingDB Entry DOI: 10.7270/Q28S4N46
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Displayed 1 to 50 (of 264 total )  |  Next  |  Last  >>
Jump to: