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Compile Data Set for Download or QSAR

Found 5 hits with Last Name = 'lyu' and Initial = 'sy'   
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
Fatty acid synthase


(Gallus gallus (Chicken))
BDBM240798
PNG
(Ginkgolic acid C17:2 (2))
Show SMILES CCCCC\C=C\C\C=C\CCCCCCCc1cccc(O)c1C(O)=O
Show InChI InChI=1S/C24H36O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21-19-17-20-22(25)23(21)24(26)27/h6-7,9-10,17,19-20,25H,2-5,8,11-16,18H2,1H3,(H,26,27)/b7-6+,10-9+
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MCE
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 9.20E+3n/an/an/an/a7.037



Yeungnam University



Assay Description
To each microtube (final volume: 100 μL), FAS was added (20-30 μg protein) in a buffer containing 100 mM potassium phosphate (pH 7.0), 2.5 ...


J Enzyme Inhib Med Chem 28: 565-8 (2013)


Article DOI: 10.3109/14756366.2012.658786
BindingDB Entry DOI: 10.7270/Q2D21WHW
More data for this
Ligand-Target Pair
Fatty acid synthase


(Gallus gallus (Chicken))
BDBM50259930
PNG
(6-(10'Z-heptadecenyl)-salicylicacid | 6-[10'(Z)-he...)
Show SMILES CCCCCC\C=C/CCCCCCCCCc1cccc(O)c1C(O)=O
Show InChI InChI=1S/C24H38O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21-19-17-20-22(25)23(21)24(26)27/h7-8,17,19-20,25H,2-6,9-16,18H2,1H3,(H,26,27)/b8-7-
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CHEMBL
MCE
PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 1.05E+4n/an/an/an/a7.037



Yeungnam University



Assay Description
To each microtube (final volume: 100 μL), FAS was added (20-30 μg protein) in a buffer containing 100 mM potassium phosphate (pH 7.0), 2.5 ...


J Enzyme Inhib Med Chem 28: 565-8 (2013)


Article DOI: 10.3109/14756366.2012.658786
BindingDB Entry DOI: 10.7270/Q2D21WHW
More data for this
Ligand-Target Pair
Fatty acid synthase


(Gallus gallus (Chicken))
BDBM50009248
PNG
((2R,3S)-3-((4E,7E)-Nona-4,7-dienoyl)-oxirane-2-car...)
Show SMILES C\C=C\C\C=C\CCC(=O)[C@H]1O[C@H]1C(N)=O |r|
Show InChI InChI=1S/C12H17NO3/c1-2-3-4-5-6-7-8-9(14)10-11(16-10)12(13)15/h2-3,5-6,10-11H,4,7-8H2,1H3,(H2,13,15)/b3-2+,6-5+/t10-,11-/m1/s1
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KEGG
MMDB
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PDB
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Article
PubMed
n/an/a 1.30E+4n/an/an/an/a7.037



Yeungnam University



Assay Description
To each microtube (final volume: 100 μL), FAS was added (20-30 μg protein) in a buffer containing 100 mM potassium phosphate (pH 7.0), 2.5 ...


J Enzyme Inhib Med Chem 28: 565-8 (2013)


Article DOI: 10.3109/14756366.2012.658786
BindingDB Entry DOI: 10.7270/Q2D21WHW
More data for this
Ligand-Target Pair
Fatty acid synthase


(Gallus gallus (Chicken))
BDBM50242188
PNG
(6-(8'Z-pentadecenyl)-salicylicacid | 6-[8'(Z)-pent...)
Show SMILES CCCCCC\C=C/CCCCCCCc1cccc(O)c1C(O)=O
Show InChI InChI=1S/C22H34O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-17-15-18-20(23)21(19)22(24)25/h7-8,15,17-18,23H,2-6,9-14,16H2,1H3,(H,24,25)/b8-7-
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CHEMBL
MCE
KEGG
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Article
PubMed
n/an/a 1.71E+4n/an/an/an/a7.037



Yeungnam University



Assay Description
To each microtube (final volume: 100 μL), FAS was added (20-30 μg protein) in a buffer containing 100 mM potassium phosphate (pH 7.0), 2.5 ...


J Enzyme Inhib Med Chem 28: 565-8 (2013)


Article DOI: 10.3109/14756366.2012.658786
BindingDB Entry DOI: 10.7270/Q2D21WHW
More data for this
Ligand-Target Pair
Fatty acid synthase


(Gallus gallus (Chicken))
BDBM7459
PNG
(2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-chromen-4...)
Show SMILES Oc1cc(O)c2c(c1)oc(cc2=O)-c1ccc(O)c(O)c1
Show InChI InChI=1S/C15H10O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-6,16-19H
UniProtKB/SwissProt

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CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

Article
PubMed
n/an/a 6.25E+4n/an/an/an/a7.037



Yeungnam University



Assay Description
To each microtube (final volume: 100 μL), FAS was added (20-30 μg protein) in a buffer containing 100 mM potassium phosphate (pH 7.0), 2.5 ...


J Enzyme Inhib Med Chem 28: 565-8 (2013)


Article DOI: 10.3109/14756366.2012.658786
BindingDB Entry DOI: 10.7270/Q2D21WHW
More data for this
Ligand-Target Pair