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Compile Data Set for Download or QSAR

Found 91 hits with Last Name = 'keillor' and Initial = 'jw'   
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
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50241226
PNG
(CHEMBL4079863)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
6.40E+3n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL




J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50241220
PNG
(CHEMBL4062721)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
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GoogleScholar
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CHEMBL
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UniChem
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PubMed
6.70E+3n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL




J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50241237
PNG
(CHEMBL4084407)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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GoogleScholar
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PubMed
8.80E+3n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL




J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50241228
PNG
(CHEMBL4093689)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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PubMed
8.90E+3n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL




J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50241225
PNG
(CHEMBL4067612)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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9.10E+3n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL




J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50241219
PNG
(CHEMBL4061658)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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1.04E+4n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL




J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50241224
PNG
(CHEMBL4092161)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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1.10E+4n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL




J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50241234
PNG
(CHEMBL4104504)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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1.12E+4n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL




J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50241218
PNG
(CHEMBL4103395)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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1.29E+4n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL




J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50241239
PNG
(CHEMBL4072990)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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1.34E+4n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL




J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50241223
PNG
(CHEMBL4071367)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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1.47E+4n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL




J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50400625
PNG
(CHEMBL2203469)
Show SMILES Clc1ccccc1N1CCN(CC1)C(=O)[C@H](CCCCNC(=O)C=C)NC(=O)OCc1ccccc1 |r|
Show InChI InChI=1S/C27H33ClN4O4/c1-2-25(33)29-15-9-8-13-23(30-27(35)36-20-21-10-4-3-5-11-21)26(34)32-18-16-31(17-19-32)24-14-7-6-12-22(24)28/h2-7,10-12,14,23H,1,8-9,13,15-20H2,(H,29,33)(H,30,35)/t23-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

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1.74E+4n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL




J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50241230
PNG
(CHEMBL4064406)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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UniChem
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2.00E+4n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL




J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50241232
PNG
(CHEMBL4097427)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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GoogleScholar
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UniChem
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PubMed
2.34E+4n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL




J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50241216
PNG
(CHEMBL4079148)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
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GoogleScholar
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CHEMBL
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PubMed
2.35E+4n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL




J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50241241
PNG
(CHEMBL4102452)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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GoogleScholar
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CHEMBL
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UniChem
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PubMed
2.71E+4n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL




J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50400644
PNG
(CHEMBL2203460)
Show SMILES C=CC(=O)NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOCC1 |r|
Show InChI InChI=1S/C21H29N3O5/c1-2-19(25)22-11-7-6-10-18(20(26)24-12-14-28-15-13-24)23-21(27)29-16-17-8-4-3-5-9-17/h2-5,8-9,18H,1,6-7,10-16H2,(H,22,25)(H,23,27)/t18-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
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CHEMBL
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PubMed
2.89E+4n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL




J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50241215
PNG
(CHEMBL4084496)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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GoogleScholar
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CHEMBL
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UniChem
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PubMed
3.05E+4n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL




J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50241231
PNG
(CHEMBL4102329)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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GoogleScholar
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CHEMBL
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PubMed
3.21E+4n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL




J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50241217
PNG
(CHEMBL4099998)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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PubMed
3.39E+4n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL




J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50241214
PNG
(CHEMBL4094701)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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PubMed
3.51E+4n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL




J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50241238
PNG
(CHEMBL4088837)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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3.60E+4n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL




J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50241229
PNG
(CHEMBL4085939)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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GoogleScholar
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CHEMBL
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UniChem
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PubMed
3.66E+4n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL




J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50241233
PNG
(CHEMBL4069260)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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PubMed
3.87E+4n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL




J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50241236
PNG
(CHEMBL4074199)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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CHEMBL
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UniChem
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PubMed
4.00E+4n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL


Assay Description
Binding affinity for human placental microsome cytochrome P450 19A1 with 1 uM [1-beta-3H]-androstenedione


J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50241227
PNG
(CHEMBL4098628)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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CHEMBL
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UniChem
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PubMed
4.01E+4n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL


Assay Description
Binding affinity for human placental microsome cytochrome P450 19A1 with 1 uM [1-beta-3H]-androstenedione


J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50241246
PNG
(CHEMBL4089771)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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Patents

Article
PubMed
4.77E+4n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL




J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50241235
PNG
(CHEMBL4073135)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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CHEMBL
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PubMed
4.81E+4n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL




J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50241240
PNG
(CHEMBL4078058)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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PubMed
5.21E+4n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL




J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Gamma-glutamyltranspeptidase 1


(Rattus norvegicus)
BDBM50148335
PNG
(1-Carboxy-3-[2-(carboxymethyl-carbamoyl)-ethanesul...)
Show SMILES [NH3+]C(CCS(=O)CCC(=O)NCC(O)=O)C(O)=O
Show InChI InChI=1S/C9H16N2O6S/c10-6(9(15)16)1-3-18(17)4-2-7(12)11-5-8(13)14/h6H,1-5,10H2,(H,11,12)(H,13,14)(H,15,16)/p+1
KEGG

UniProtKB/SwissProt

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5.30E+4n/an/an/an/an/an/a8.0n/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Compound tested for the inhibition of Gamma-glutamyltranspeptidase in rat kidney at pH 8.0 at 37 degree C (Competitive inhibition)


Bioorg Med Chem Lett 14: 3451-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.04.072
BindingDB Entry DOI: 10.7270/Q2X63NHS
More data for this
Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (TG2)


(Homo sapiens (Human))
BDBM50400618
PNG
(CHEMBL2203477)
Show SMILES OC(=O)[C@H](CCCCNC(=O)C=C)NC(=O)OCc1ccccc1 |r|
Show InChI InChI=1S/C17H22N2O5/c1-2-15(20)18-11-7-6-10-14(16(21)22)19-17(23)24-12-13-8-4-3-5-9-13/h2-5,8-9,14H,1,6-7,10-12H2,(H,18,20)(H,19,23)(H,21,22)/t14-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

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UniChem
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PubMed
6.03E+4n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL




J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
More data for this
Ligand-Target Pair
Gamma-glutamyltranspeptidase 1


(Rattus norvegicus)
BDBM50148333
PNG
((S)-1-Carboxy-3-[4-(carboxymethyl-carbamoyl)-pheny...)
Show SMILES [NH3+][C@@H](CCS(=O)Cc1ccc(cc1)C(=O)NCC(O)=O)C(O)=O
Show InChI InChI=1S/C14H18N2O6S/c15-11(14(20)21)5-6-23(22)8-9-1-3-10(4-2-9)13(19)16-7-12(17)18/h1-4,11H,5-8,15H2,(H,16,19)(H,17,18)(H,20,21)/p+1/t11-,23?/m0/s1
KEGG

UniProtKB/SwissProt

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CHEMBL
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UniChem
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2.30E+5n/an/an/an/an/an/a8.0n/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Compound tested for the inhibition of Gamma-glutamyltranspeptidase in rat kidney at pH 8.0 at 37 degree C (Competitive inhibition)


Bioorg Med Chem Lett 14: 3451-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.04.072
BindingDB Entry DOI: 10.7270/Q2X63NHS
More data for this
Ligand-Target Pair
Gamma-glutamyltranspeptidase 1


(Rattus norvegicus)
BDBM50148336
PNG
((1S)-1-carboxy-3-({2-[(carboxymethyl)amino]-2-oxoe...)
Show SMILES [NH3+][C@@H](CCSCCC(=O)NCC(O)=O)C(O)=O
Show InChI InChI=1S/C9H16N2O5S/c10-6(9(15)16)1-3-17-4-2-7(12)11-5-8(13)14/h6H,1-5,10H2,(H,11,12)(H,13,14)(H,15,16)/p+1/t6-/m0/s1
KEGG

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PubMed
5.20E+5n/an/an/an/an/an/a8.0n/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Compound tested for the inhibition of Gamma-glutamyltranspeptidase in rat kidney at pH 8.0 at 37 degree C (Competitive inhibition)


Bioorg Med Chem Lett 14: 3451-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.04.072
BindingDB Entry DOI: 10.7270/Q2X63NHS
More data for this
Ligand-Target Pair
Gamma-glutamyltranspeptidase 1


(Rattus norvegicus)
BDBM50148332
PNG
(1-Carboxy-3-[2-(carboxymethyl-carbamoyl)-ethanesul...)
Show SMILES [NH3+][C@@H](CCS(=O)(=O)CCC(=O)NCC(O)=O)C(O)=O
Show InChI InChI=1S/C9H16N2O7S/c10-6(9(15)16)1-3-19(17,18)4-2-7(12)11-5-8(13)14/h6H,1-5,10H2,(H,11,12)(H,13,14)(H,15,16)/p+1/t6-/m0/s1
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3.50E+6n/an/an/an/an/an/a8.0n/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Compound tested for the inhibition of Gamma-glutamyltranspeptidase in rat kidney at pH 8.0 at 37 degree C


Bioorg Med Chem Lett 14: 3451-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.04.072
BindingDB Entry DOI: 10.7270/Q2X63NHS
More data for this
Ligand-Target Pair
Gamma-glutamyltranspeptidase 1


(Rattus norvegicus)
BDBM50366922
PNG
(METHIONINE SULFOXIDE)
Show SMILES CS(=O)CC[C@H](N)C(O)=O |r|
Show InChI InChI=1S/C5H11NO3S/c1-10(9)3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)/t4-,10?/m0/s1
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5.90E+6n/an/an/an/an/an/a8.0n/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Compound tested for the inhibition of Gamma-glutamyltranspeptidase in rat kidney at pH 8.0 at 37 degree C (Competitive inhibition)


Bioorg Med Chem Lett 14: 3451-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.04.072
BindingDB Entry DOI: 10.7270/Q2X63NHS
More data for this
Ligand-Target Pair
Gamma-glutamyltranspeptidase 1


(Rattus norvegicus)
BDBM50142500
PNG
((2S)-2-amino-4-(methylsulfanyl)butanoic acid | (S)...)
Show SMILES CSCC[C@H](N)C(O)=O |r|
Show InChI InChI=1S/C5H11NO2S/c1-9-3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)/t4-/m0/s1
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PubMed
2.69E+7n/an/an/an/an/an/a8.0n/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Compound tested for the inhibition of Gamma-glutamyltranspeptidase in rat kidney at pH 8.0 at 37 degree C (Competitive inhibition)


Bioorg Med Chem Lett 14: 3451-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.04.072
BindingDB Entry DOI: 10.7270/Q2X63NHS
More data for this
Ligand-Target Pair
Transglutaminases (TGase)


(Cavia cutleri (Guinea pig))
BDBM185758
PNG
(US9162991, 4d)
Show SMILES [O-][N+](=O)c1ccc(Cn2cc(nn2)C(=O)\C=C\c2ccc(cc2)N(=O)=O)cc1
Show InChI InChI=1S/C18H13N5O5/c24-18(10-5-13-1-6-15(7-2-13)22(25)26)17-12-21(20-19-17)11-14-3-8-16(9-4-14)23(27)28/h1-10,12H,11H2/b10-5+
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n/an/a 2.10E+3n/an/an/an/an/an/a



University of Ottawa

US Patent


Assay Description
For enzymology studies of these compounds, recombinant guinea pig liver TGase was expressed in Escherichia coli and effectively purified (Gillet, S. ...


US Patent US9162991 (2015)


BindingDB Entry DOI: 10.7270/Q2VD6X8J
More data for this
Ligand-Target Pair
Transglutaminases (TGase)


(Cavia cutleri (Guinea pig))
BDBM185754
PNG
(US9162991, 4a)
Show SMILES O=C(\C=C\c1ccc(cc1)N(=O)=O)c1cn(Cc2ccccc2)nn1
Show InChI InChI=1S/C18H14N4O3/c23-18(11-8-14-6-9-16(10-7-14)22(24)25)17-13-21(20-19-17)12-15-4-2-1-3-5-15/h1-11,13H,12H2/b11-8+
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n/an/a 4.30E+3n/an/an/an/an/an/a



University of Ottawa

US Patent


Assay Description
For enzymology studies of these compounds, recombinant guinea pig liver TGase was expressed in Escherichia coli and effectively purified (Gillet, S. ...


US Patent US9162991 (2015)


BindingDB Entry DOI: 10.7270/Q2VD6X8J
More data for this
Ligand-Target Pair
Transglutaminases (TGase)


(Cavia cutleri (Guinea pig))
BDBM185762
PNG
(US9162991, 4h)
Show SMILES [O-][N+](=O)c1cccc(Cn2cc(nn2)C(=O)\C=C\c2ccc(cc2)N(=O)=O)c1
Show InChI InChI=1S/C18H13N5O5/c24-18(9-6-13-4-7-15(8-5-13)22(25)26)17-12-21(20-19-17)11-14-2-1-3-16(10-14)23(27)28/h1-10,12H,11H2/b9-6+
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n/an/a 9.40E+3n/an/an/an/an/an/a



University of Ottawa

US Patent


Assay Description
For enzymology studies of these compounds, recombinant guinea pig liver TGase was expressed in Escherichia coli and effectively purified (Gillet, S. ...


US Patent US9162991 (2015)


BindingDB Entry DOI: 10.7270/Q2VD6X8J
More data for this
Ligand-Target Pair
Transglutaminases (TGase)


(Cavia cutleri (Guinea pig))
BDBM185762
PNG
(US9162991, 4h)
Show SMILES [O-][N+](=O)c1cccc(Cn2cc(nn2)C(=O)\C=C\c2ccc(cc2)N(=O)=O)c1
Show InChI InChI=1S/C18H13N5O5/c24-18(9-6-13-4-7-15(8-5-13)22(25)26)17-12-21(20-19-17)11-14-2-1-3-16(10-14)23(27)28/h1-10,12H,11H2/b9-6+
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n/an/a 1.07E+4n/an/an/an/an/an/a



University of Ottawa

US Patent


Assay Description
For enzymology studies of these compounds, recombinant guinea pig liver TGase was expressed in Escherichia coli and effectively purified (Gillet, S. ...


US Patent US9162991 (2015)


BindingDB Entry DOI: 10.7270/Q2VD6X8J
More data for this
Ligand-Target Pair
Transglutaminases (TGase)


(Cavia cutleri (Guinea pig))
BDBM185761
PNG
(US9162991, 4f)
Show SMILES O=C(\C=C\c1ccc(cc1)N(=O)=O)c1cn(CC2CCCCC2)nn1
Show InChI InChI=1S/C18H20N4O3/c23-18(11-8-14-6-9-16(10-7-14)22(24)25)17-13-21(20-19-17)12-15-4-2-1-3-5-15/h6-11,13,15H,1-5,12H2/b11-8+
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n/an/a 1.10E+4n/an/an/an/an/an/a



University of Ottawa

US Patent


Assay Description
For enzymology studies of these compounds, recombinant guinea pig liver TGase was expressed in Escherichia coli and effectively purified (Gillet, S. ...


US Patent US9162991 (2015)


BindingDB Entry DOI: 10.7270/Q2VD6X8J
More data for this
Ligand-Target Pair
Transglutaminases (TGase)


(Cavia cutleri (Guinea pig))
BDBM185759
PNG
(US9162991, 4n)
Show SMILES COc1ccc(Cn2cc(nn2)C(=O)\C=C\c2ccc(cc2)N(=O)=O)cc1
Show InChI InChI=1S/C19H16N4O4/c1-27-17-9-4-15(5-10-17)12-22-13-18(20-21-22)19(24)11-6-14-2-7-16(8-3-14)23(25)26/h2-11,13H,12H2,1H3/b11-6+
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n/an/a 1.40E+4n/an/an/an/an/an/a



University of Ottawa

US Patent


Assay Description
For enzymology studies of these compounds, recombinant guinea pig liver TGase was expressed in Escherichia coli and effectively purified (Gillet, S. ...


US Patent US9162991 (2015)


BindingDB Entry DOI: 10.7270/Q2VD6X8J
More data for this
Ligand-Target Pair
Transglutaminases (TGase)


(Cavia cutleri (Guinea pig))
BDBM185765
PNG
(US9162991, 4k)
Show SMILES CC(c1ccccc1)n1cc(nn1)C(=O)\C=C\c1ccc(cc1)N(=O)=O
Show InChI InChI=1/C19H16N4O3/c1-14(16-5-3-2-4-6-16)22-13-18(20-21-22)19(24)12-9-15-7-10-17(11-8-15)23(25)26/h2-14H,1H3/b12-9+
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n/an/a 1.70E+4n/an/an/an/an/an/a



University of Ottawa

US Patent


Assay Description
For enzymology studies of these compounds, recombinant guinea pig liver TGase was expressed in Escherichia coli and effectively purified (Gillet, S. ...


US Patent US9162991 (2015)


BindingDB Entry DOI: 10.7270/Q2VD6X8J
More data for this
Ligand-Target Pair
Transglutaminases (TGase)


(Cavia cutleri (Guinea pig))
BDBM185760
PNG
(US9162991, 4e)
Show SMILES O=C(\C=C\c1ccc(cc1)N(=O)=O)c1cn(Cc2ccccn2)nn1
Show InChI InChI=1S/C17H13N5O3/c23-17(9-6-13-4-7-15(8-5-13)22(24)25)16-12-21(20-19-16)11-14-3-1-2-10-18-14/h1-10,12H,11H2/b9-6+
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n/an/a 1.80E+4n/an/an/an/an/an/a



University of Ottawa

US Patent


Assay Description
For enzymology studies of these compounds, recombinant guinea pig liver TGase was expressed in Escherichia coli and effectively purified (Gillet, S. ...


US Patent US9162991 (2015)


BindingDB Entry DOI: 10.7270/Q2VD6X8J
More data for this
Ligand-Target Pair
Transglutaminases (TGase)


(Cavia cutleri (Guinea pig))
BDBM185781
PNG
(US9162991, 15n)
Show SMILES OB(C#N)c1ccc(\C=C\C(=O)n2nnc3ccccc23)cc1
Show InChI InChI=1S/C16H11BN4O2/c18-11-17(23)13-8-5-12(6-9-13)7-10-16(22)21-15-4-2-1-3-14(15)19-20-21/h1-10,23H/b10-7+
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US Patent
n/an/a 1.80E+4n/an/an/an/an/an/a



University of Ottawa

US Patent


Assay Description
For enzymology studies of these compounds, recombinant guinea pig liver TGase was expressed in Escherichia coli and effectively purified (Gillet, S. ...


US Patent US9162991 (2015)


BindingDB Entry DOI: 10.7270/Q2VD6X8J
More data for this
Ligand-Target Pair
Transglutaminases (TGase)


(Cavia cutleri (Guinea pig))
BDBM185742
PNG
(US9162991, 18a)
Show SMILES [O-][N+](=O)c1ccc(\C=C\C(=O)n2ccnc2)cc1
Show InChI InChI=1S/C12H9N3O3/c16-12(14-8-7-13-9-14)6-3-10-1-4-11(5-2-10)15(17)18/h1-9H/b6-3+
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n/an/a>2.00E+4n/an/an/an/an/an/a



University of Ottawa

US Patent


Assay Description
For enzymology studies of these compounds, recombinant guinea pig liver TGase was expressed in Escherichia coli and effectively purified (Gillet, S. ...


US Patent US9162991 (2015)


BindingDB Entry DOI: 10.7270/Q2VD6X8J
More data for this
Ligand-Target Pair
Transglutaminases (TGase)


(Cavia cutleri (Guinea pig))
BDBM185741
PNG
(US9162991, 16a)
Show SMILES [O-]n1n[n+](C(=O)\C=C\c2ccc(cc2)[N+]([O-])=O)c2cccnc12
Show InChI InChI=1S/C14H9N5O4/c20-13(8-5-10-3-6-11(7-4-10)19(22)23)17-12-2-1-9-15-14(12)18(21)16-17/h1-9H/b8-5+
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n/an/a>2.00E+4n/an/an/an/an/an/a



University of Ottawa

US Patent


Assay Description
For enzymology studies of these compounds, recombinant guinea pig liver TGase was expressed in Escherichia coli and effectively purified (Gillet, S. ...


US Patent US9162991 (2015)


BindingDB Entry DOI: 10.7270/Q2VD6X8J
More data for this
Ligand-Target Pair
Transglutaminases (TGase)


(Cavia cutleri (Guinea pig))
BDBM185740
PNG
(US9162991, 14a)
Show SMILES [O-]n1n[n+](C(=O)\C=C\c2ccc(cc2)[N+]([O-])=O)c2ccccc12
Show InChI InChI=1S/C15H10N4O4/c20-15(10-7-11-5-8-12(9-6-11)19(22)23)17-13-3-1-2-4-14(13)18(21)16-17/h1-10H/b10-7+
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US Patent
n/an/a>2.00E+4n/an/an/an/an/an/a



University of Ottawa

US Patent


Assay Description
For enzymology studies of these compounds, recombinant guinea pig liver TGase was expressed in Escherichia coli and effectively purified (Gillet, S. ...


US Patent US9162991 (2015)


BindingDB Entry DOI: 10.7270/Q2VD6X8J
More data for this
Ligand-Target Pair
Transglutaminases (TGase)


(Cavia cutleri (Guinea pig))
BDBM185785
PNG
(US9162991, 30a)
Show SMILES O=C(\C=C\c1ccc(cc1)N(=O)=O)c1cccnc1
Show InChI InChI=1S/C14H10N2O3/c17-14(12-2-1-9-15-10-12)8-5-11-3-6-13(7-4-11)16(18)19/h1-10H/b8-5+
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n/an/a 2.10E+4n/an/an/an/an/an/a



University of Ottawa

US Patent


Assay Description
For enzymology studies of these compounds, recombinant guinea pig liver TGase was expressed in Escherichia coli and effectively purified (Gillet, S. ...


US Patent US9162991 (2015)


BindingDB Entry DOI: 10.7270/Q2VD6X8J
More data for this
Ligand-Target Pair
Transglutaminases (TGase)


(Cavia cutleri (Guinea pig))
BDBM185768
PNG
(US9162991, 14b)
Show SMILES [O-]n1n[n+](C(=O)\C=C\c2cccc(c2)N(=O)=O)c2ccccc12
Show InChI InChI=1S/C15H10N4O4/c20-15(9-8-11-4-3-5-12(10-11)19(22)23)17-13-6-1-2-7-14(13)18(21)16-17/h1-10H/b9-8+
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n/an/a 2.40E+4n/an/an/an/an/an/a



University of Ottawa

US Patent


Assay Description
For enzymology studies of these compounds, recombinant guinea pig liver TGase was expressed in Escherichia coli and effectively purified (Gillet, S. ...


US Patent US9162991 (2015)


BindingDB Entry DOI: 10.7270/Q2VD6X8J
More data for this
Ligand-Target Pair
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