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Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Gamma-glutamylcysteine synthetase' AND taxid = 9606   
Target
(Institution)
LigandTarget
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
Gamma-glutamylcysteine synthetase


(Homo sapiens)
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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CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
390n/an/an/an/an/an/an/an/a


TBA

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


Citation and Details
More data for this
Ligand-Target Pair
Gamma-glutamylcysteine synthetase


(Homo sapiens)
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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PC cid
PC sid
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Similars

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


TBA

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


Citation and Details
More data for this
Ligand-Target Pair
Gamma-glutamylcysteine synthetase


(Homo sapiens)
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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PC cid
PC sid
UniChem
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Article
9.23E+3n/an/an/an/an/an/an/an/a


TBA

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


Citation and Details
More data for this
Ligand-Target Pair
Gamma-glutamylcysteine synthetase


(Homo sapiens)
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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CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
4.93E+4n/an/an/an/an/an/an/an/a


TBA

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


Citation and Details
More data for this
Ligand-Target Pair