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PubMed code 2788743

Compile data set for download or QSAR
Found 6 hits of Enzyme Inhibition Constant Data   
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
ATP-citrate synthase


(Rattus norvegicus)
BDBM50018569
PNG
(3,3,14,14-Tetramethyl-hexadecanedioic acid | CHEMB...)
Show SMILES CC(C)(CCCCCCCCCCC(C)(C)CC(O)=O)CC(O)=O
Show InChI InChI=1S/C20H38O4/c1-19(2,15-17(21)22)13-11-9-7-5-6-8-10-12-14-20(3,4)16-18(23)24/h5-16H2,1-4H3,(H,21,22)(H,23,24)
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PubMed
1.60E+7n/an/an/an/an/an/an/an/a



Hebrew University

Curated by ChEMBL


Assay Description
Inhibition against ATP-citrate lyase in liver.


J Med Chem 32: 2072-84 (1989)


BindingDB Entry DOI: 10.7270/Q2N015HP
More data for this
Ligand-Target Pair
ATP-citrate synthase


(Rattus norvegicus)
BDBM50018564
PNG
(3,3,16,16-Tetramethyl-octadecanedioic acid | CHEMB...)
Show SMILES CC(C)(CCCCCCCCCCCCC(C)(C)CC(O)=O)CC(O)=O
Show InChI InChI=1S/C22H42O4/c1-21(2,17-19(23)24)15-13-11-9-7-5-6-8-10-12-14-16-22(3,4)18-20(25)26/h5-18H2,1-4H3,(H,23,24)(H,25,26)
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4.60E+7n/an/an/an/an/an/an/an/a



Hebrew University

Curated by ChEMBL


Assay Description
Inhibition against ATP-citrate lyase in liver


J Med Chem 32: 2072-84 (1989)


BindingDB Entry DOI: 10.7270/Q2N015HP
More data for this
Ligand-Target Pair
ATP-citrate synthase


(Rattus norvegicus)
BDBM50018566
PNG
(3,3,12,12-Tetramethyl-tetradecanedioic acid | CHEM...)
Show SMILES CC(C)(CCCCCCCCC(C)(C)CC(O)=O)CC(O)=O
Show InChI InChI=1S/C18H34O4/c1-17(2,13-15(19)20)11-9-7-5-6-8-10-12-18(3,4)14-16(21)22/h5-14H2,1-4H3,(H,19,20)(H,21,22)
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PubMed
5.60E+7n/an/an/an/an/an/an/an/a



Hebrew University

Curated by ChEMBL


Assay Description
Inhibition against ATP-citrate lyase in rat liver.


J Med Chem 32: 2072-84 (1989)


BindingDB Entry DOI: 10.7270/Q2N015HP
More data for this
Ligand-Target Pair
ATP-citrate synthase


(Rattus norvegicus)
BDBM50018568
PNG
(3,3,18,18-Tetramethyl-icosanedioic acid | CHEMBL66...)
Show SMILES CC(C)(CCCCCCCCCCCCCCC(C)(C)CC(O)=O)CC(O)=O
Show InChI InChI=1S/C24H46O4/c1-23(2,19-21(25)26)17-15-13-11-9-7-5-6-8-10-12-14-16-18-24(3,4)20-22(27)28/h5-20H2,1-4H3,(H,25,26)(H,27,28)
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2.60E+8n/an/an/an/an/an/an/an/a



Hebrew University

Curated by ChEMBL


Assay Description
Inhibition against ATP-citrate lyase in liver


J Med Chem 32: 2072-84 (1989)


BindingDB Entry DOI: 10.7270/Q2N015HP
More data for this
Ligand-Target Pair
ATP-citrate synthase


(Rattus norvegicus)
BDBM50018567
PNG
(3,3,10,10-Tetramethyl-dodecanedioic acid | CHEMBL6...)
Show SMILES CC(C)(CCCCCCC(C)(C)CC(O)=O)CC(O)=O
Show InChI InChI=1S/C16H30O4/c1-15(2,11-13(17)18)9-7-5-6-8-10-16(3,4)12-14(19)20/h5-12H2,1-4H3,(H,17,18)(H,19,20)
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PubMed
3.10E+8n/an/an/an/an/an/an/an/a



Hebrew University

Curated by ChEMBL


Assay Description
Inhibition against ATP-citrate lyase in rat liver


J Med Chem 32: 2072-84 (1989)


BindingDB Entry DOI: 10.7270/Q2N015HP
More data for this
Ligand-Target Pair
ATP-citrate synthase


(Rattus norvegicus)
BDBM50018565
PNG
(3,3,20,20-Tetramethyl-docosanedioic acid | CHEMBL6...)
Show SMILES CC(C)(CCCCCCCCCCCCCCCCC(C)(C)CC(O)=O)CC(O)=O
Show InChI InChI=1S/C26H50O4/c1-25(2,21-23(27)28)19-17-15-13-11-9-7-5-6-8-10-12-14-16-18-20-26(3,4)22-24(29)30/h5-22H2,1-4H3,(H,27,28)(H,29,30)
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PubMed
3.20E+8n/an/an/an/an/an/an/an/a



Hebrew University

Curated by ChEMBL


Assay Description
Inhibition against ATP-citrate lyase in liver


J Med Chem 32: 2072-84 (1989)


BindingDB Entry DOI: 10.7270/Q2N015HP
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%