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Compile Data Set for Download or QSAR

Found 5 hits Enz. Inhib. hit(s) with Target = 'Glutamate--cysteine ligase catalytic subunit'   
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
Glutamate--cysteine ligase catalytic subunit


(Homo sapiens (Human))
BDBM50366432
PNG
(CHEMBL1627263)
Show SMILES CCC(CS(=N)(=O)CCC(=N)C(O)=O)C(O)=O
Show InChI InChI=1S/C9H18N2O5S/c1-2-6(8(12)13)5-17(11,16)4-3-7(10)9(14)15/h6,10,17H,2-5H2,1H3,(H2,11,16)(H,12,13)(H,14,15)
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Article
390n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Tested for inhibition of Escherichia coli gamma-glutamylcysteine synthetase at a concentration of 5.1 uM


Bioorg Med Chem Lett 6: 1437-1442 (1996)


Article DOI: 10.1016/S0960-894X(96)00247-8
BindingDB Entry DOI: 10.7270/Q2KH0NV4
More data for this
Ligand-Target Pair
Glutamate--cysteine ligase catalytic subunit


(Homo sapiens (Human))
BDBM50287274
PNG
((2S)-2-ammonio-4-[(2-carboxylatobutyl)phosphinato]...)
Show SMILES CCC(CP([O-])(=O)CC[C@H]([NH3+])C([O-])=O)C([O-])=O
Show InChI InChI=1S/C9H18NO6P/c1-2-6(8(11)12)5-17(15,16)4-3-7(10)9(13)14/h6-7H,2-5,10H2,1H3,(H,11,12)(H,13,14)(H,15,16)/p-2/t6?,7-/m0/s1
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Similars

Article
4.95E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Tested for inhibition of Escherichia coli gamma-glutamylcysteine synthetase at a concentration of 5.7 uM


Bioorg Med Chem Lett 6: 1437-1442 (1996)


Article DOI: 10.1016/S0960-894X(96)00247-8
BindingDB Entry DOI: 10.7270/Q2KH0NV4
More data for this
Ligand-Target Pair
Glutamate--cysteine ligase catalytic subunit


(Homo sapiens (Human))
BDBM50287275
PNG
(2-ammonio-4-[(2-carboxylatobutyl)sulfonyl]butanoat...)
Show SMILES CCC(CS(=O)(=O)CCC([NH3+])C([O-])=O)C([O-])=O
Show InChI InChI=1S/C9H17NO6S/c1-2-6(8(11)12)5-17(15,16)4-3-7(10)9(13)14/h6-7H,2-5,10H2,1H3,(H,11,12)(H,13,14)/p-1
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Article
9.23E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Tested for inhibition of Escherichia coli gamma-glutamylcysteine synthetase at a concentration of 16.3 uM


Bioorg Med Chem Lett 6: 1437-1442 (1996)


Article DOI: 10.1016/S0960-894X(96)00247-8
BindingDB Entry DOI: 10.7270/Q2KH0NV4
More data for this
Ligand-Target Pair
Glutamate--cysteine ligase catalytic subunit


(Homo sapiens (Human))
BDBM50366433
PNG
(CHEMBL1609891)
Show SMILES CCCCS(=N)(=O)CCC(=N)C(O)=O
Show InChI InChI=1S/C8H18N2O3S/c1-2-3-5-14(10,13)6-4-7(9)8(11)12/h9,14H,2-6H2,1H3,(H2,10,13)(H,11,12)
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Article
4.93E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Tested for inhibition of Escherichia coli gamma-glutamylcysteine synthetase at a concentration of 25.0 uM


Bioorg Med Chem Lett 6: 1437-1442 (1996)


Article DOI: 10.1016/S0960-894X(96)00247-8
BindingDB Entry DOI: 10.7270/Q2KH0NV4
More data for this
Ligand-Target Pair
Glutamate--cysteine ligase catalytic subunit


(Rattus norvegicus)
BDBM50487312
PNG
(BUTHIONINE SULFOXIME)
Show SMILES CCCCS(=N)(=O)CC[C@H](N)C(O)=O
Show InChI InChI=1S/C8H18N2O3S/c1-2-3-5-14(10,13)6-4-7(9)8(11)12/h7,10H,2-6,9H2,1H3,(H,11,12)/t7-,14?/m0/s1
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MCE
KEGG
PC cid
PC sid
PDB
UniChem
Article
1.30E+7n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Rattus norvegicus Wistar (rat) rat glutamate cysteine ligase using glutamate as substrate incubated for 10 min prior to substrate addit...


Citation and Details

Article DOI: 10.1007/s00044-004-0112-9
BindingDB Entry DOI: 10.7270/Q28S4STT
More data for this
Ligand-Target Pair