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PubMed code 23419736

Compile data set for download or QSAR
Found 58 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
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430492
PNG
(CHEMBL2335528)
Show SMILES CCCCCCCCCCCCS(=O)(=O)C1=CC(=O)c2c(OC)ccc(OC)c2C1=O
Show InChI InChI=1S/C24H34O6S/c1-4-5-6-7-8-9-10-11-12-13-16-31(27,28)21-17-18(25)22-19(29-2)14-15-20(30-3)23(22)24(21)26/h14-15,17H,4-13,16H2,1-3H3
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n/an/a 440n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430480
PNG
(CHEMBL2335539)
Show SMILES CCCCCCCCCCSC1=CC(=O)c2ccccc2C1=O
Show InChI InChI=1S/C20H26O2S/c1-2-3-4-5-6-7-8-11-14-23-19-15-18(21)16-12-9-10-13-17(16)20(19)22/h9-10,12-13,15H,2-8,11,14H2,1H3
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n/an/a 600n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430507
PNG
(CHEMBL2335563)
Show SMILES CCCCCCCCCC=CS(=O)c1cc(O)c2c(OC)ccc(OC)c2c1O
Show InChI InChI=1S/C23H32O5S/c1-4-5-6-7-8-9-10-11-12-15-29(26)20-16-17(24)21-18(27-2)13-14-19(28-3)22(21)23(20)25/h12-16,24-25H,4-11H2,1-3H3
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n/an/a 1.10E+3n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430476
PNG
(CHEMBL2335542)
Show SMILES CCCCCCCCCCCCCCCCCCSC1=CC(=O)c2ccccc2C1=O
Show InChI InChI=1S/C28H42O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-31-27-23-26(29)24-20-17-18-21-25(24)28(27)30/h17-18,20-21,23H,2-16,19,22H2,1H3
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n/an/a 1.45E+3n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430481
PNG
(CHEMBL2335538)
Show SMILES CCCCCCCCCSC1=CC(=O)c2ccccc2C1=O
Show InChI InChI=1S/C19H24O2S/c1-2-3-4-5-6-7-10-13-22-18-14-17(20)15-11-8-9-12-16(15)19(18)21/h8-9,11-12,14H,2-7,10,13H2,1H3
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n/an/a 1.63E+3n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430478
PNG
(CHEMBL2335540)
Show SMILES CCCCCCCCCCCCSC1=CC(=O)c2ccccc2C1=O
Show InChI InChI=1S/C22H30O2S/c1-2-3-4-5-6-7-8-9-10-13-16-25-21-17-20(23)18-14-11-12-15-19(18)22(21)24/h11-12,14-15,17H,2-10,13,16H2,1H3
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n/an/a 1.66E+3n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430506
PNG
(CHEMBL2335564)
Show SMILES CCCCCCCCCCC=CS(=O)c1cc(O)c2c(OC)ccc(OC)c2c1O
Show InChI InChI=1S/C24H34O5S/c1-4-5-6-7-8-9-10-11-12-13-16-30(27)21-17-18(25)22-19(28-2)14-15-20(29-3)23(22)24(21)26/h13-17,25-26H,4-12H2,1-3H3
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n/an/a 2.40E+3n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430489
PNG
(CHEMBL2335531)
Show SMILES CSC1=CC(=O)c2ccccc2C1=O
Show InChI InChI=1S/C11H8O2S/c1-14-10-6-9(12)7-4-2-3-5-8(7)11(10)13/h2-6H,1H3
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n/an/a 2.82E+3n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430493
PNG
(CHEMBL2335527)
Show SMILES CCCCCCCCCCCS(=O)(=O)C1=CC(=O)c2c(OC)ccc(OC)c2C1=O
Show InChI InChI=1S/C23H32O6S/c1-4-5-6-7-8-9-10-11-12-15-30(26,27)20-16-17(24)21-18(28-2)13-14-19(29-3)22(21)23(20)25/h13-14,16H,4-12,15H2,1-3H3
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n/an/a 3.40E+3n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430462
PNG
(RETROFRACTAMIDE B)
Show SMILES CC(C)CNC(=O)\C=C\C=C\CCCC\C=C\c1ccc2OCOc2c1
Show InChI InChI=1S/C22H29NO3/c1-18(2)16-23-22(24)12-10-8-6-4-3-5-7-9-11-19-13-14-20-21(15-19)26-17-25-20/h6,8-15,18H,3-5,7,16-17H2,1-2H3,(H,23,24)/b8-6+,11-9+,12-10+
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n/an/a 3.70E+3n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430477
PNG
(CHEMBL2335541)
Show SMILES CCCCCCCCCCCCCCCSC1=CC(=O)c2ccccc2C1=O
Show InChI InChI=1S/C25H36O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-19-28-24-20-23(26)21-17-14-15-18-22(21)25(24)27/h14-15,17-18,20H,2-13,16,19H2,1H3
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n/an/a 4.13E+3n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430487
PNG
(CHEMBL2335532)
Show SMILES CCCSC1=CC(=O)c2ccccc2C1=O
Show InChI InChI=1S/C13H12O2S/c1-2-7-16-12-8-11(14)9-5-3-4-6-10(9)13(12)15/h3-6,8H,2,7H2,1H3
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n/an/a 5.08E+3n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430467
PNG
(CHEMBL2335551)
Show SMILES CCCCCCCC=CS(=O)c1cc(O)c2ccccc2c1O
Show InChI InChI=1S/C19H24O3S/c1-2-3-4-5-6-7-10-13-23(22)18-14-17(20)15-11-8-9-12-16(15)19(18)21/h8-14,20-21H,2-7H2,1H3
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n/an/a 5.47E+3n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430475
PNG
(CHEMBL2335543)
Show SMILES CS(=O)C1=CC(=O)c2ccccc2C1=O
Show InChI InChI=1S/C11H8O3S/c1-15(14)10-6-9(12)7-4-2-3-5-8(7)11(10)13/h2-6H,1H3
KEGG

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n/an/a 5.66E+3n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430491
PNG
(CHEMBL2335529)
Show SMILES CCCCCCCCCCCCCCCS(=O)(=O)C1=CC(=O)c2c(OC)ccc(OC)c2C1=O
Show InChI InChI=1S/C27H40O6S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19-34(30,31)24-20-21(28)25-22(32-2)17-18-23(33-3)26(25)27(24)29/h17-18,20H,4-16,19H2,1-3H3
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n/an/a 5.80E+3n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430482
PNG
(CHEMBL2335537)
Show SMILES CCCCCCCCSC1=CC(=O)c2ccccc2C1=O
Show InChI InChI=1S/C18H22O2S/c1-2-3-4-5-6-9-12-21-17-13-16(19)14-10-7-8-11-15(14)18(17)20/h7-8,10-11,13H,2-6,9,12H2,1H3
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n/an/a 6.00E+3n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430488
PNG
(CHEMBL531383 | GNF-Pf-2144)
Show SMILES CCSC1=CC(=O)c2ccccc2C1=O
Show InChI InChI=1S/C12H10O2S/c1-2-15-11-7-10(13)8-5-3-4-6-9(8)12(11)14/h3-7H,2H2,1H3
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n/an/a 7.51E+3n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430486
PNG
(CHEMBL2335533)
Show SMILES CCCCSC1=CC(=O)c2ccccc2C1=O
Show InChI InChI=1S/C14H14O2S/c1-2-3-8-17-13-9-12(15)10-6-4-5-7-11(10)14(13)16/h4-7,9H,2-3,8H2,1H3
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n/an/a 7.87E+3n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430485
PNG
(CHEMBL2335534)
Show SMILES CCCCCSC1=CC(=O)c2ccccc2C1=O
Show InChI InChI=1S/C15H16O2S/c1-2-3-6-9-18-14-10-13(16)11-7-4-5-8-12(11)15(14)17/h4-5,7-8,10H,2-3,6,9H2,1H3
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n/an/a 8.19E+3n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430508
PNG
(CHEMBL2335562)
Show SMILES CCCCCCCCC=CS(=O)c1cc(O)c2c(OC)ccc(OC)c2c1O
Show InChI InChI=1S/C22H30O5S/c1-4-5-6-7-8-9-10-11-14-28(25)19-15-16(23)20-17(26-2)12-13-18(27-3)21(20)22(19)24/h11-15,23-24H,4-10H2,1-3H3
KEGG

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PubMed
n/an/a 8.40E+3n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430479
PNG
(CHEMBL2331597)
Show SMILES CCCCCCCCCCCSC1=CC(=O)c2ccccc2C1=O
Show InChI InChI=1S/C21H28O2S/c1-2-3-4-5-6-7-8-9-12-15-24-20-16-19(22)17-13-10-11-14-18(17)21(20)23/h10-11,13-14,16H,2-9,12,15H2,1H3
KEGG

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Article
PubMed
n/an/a 8.67E+3n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430483
PNG
(CHEMBL2335536)
Show SMILES CCCCCCCSC1=CC(=O)c2ccccc2C1=O
Show InChI InChI=1S/C17H20O2S/c1-2-3-4-5-8-11-20-16-12-15(18)13-9-6-7-10-14(13)17(16)19/h6-7,9-10,12H,2-5,8,11H2,1H3
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n/an/a 1.01E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430509
PNG
(CHEMBL2335561)
Show SMILES CCCCCCCC=CS(=O)c1cc(O)c2c(OC)ccc(OC)c2c1O
Show InChI InChI=1S/C21H28O5S/c1-4-5-6-7-8-9-10-13-27(24)18-14-15(22)19-16(25-2)11-12-17(26-3)20(19)21(18)23/h10-14,22-23H,4-9H2,1-3H3
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n/an/a 1.03E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50208612
PNG
((-)-kurarinone | (2S)-2-(2,4-dihydroxyphenyl)-7-hy...)
Show SMILES COc1cc(O)c(CC(CC=C(C)C)C(C)=C)c2O[C@@H](CC(=O)c12)c1ccc(O)cc1O
Show InChI InChI=1S/C26H30O6/c1-14(2)6-7-16(15(3)4)10-19-21(29)12-24(31-5)25-22(30)13-23(32-26(19)25)18-9-8-17(27)11-20(18)28/h6,8-9,11-12,16,23,27-29H,3,7,10,13H2,1-2,4-5H3/t16?,23-/m0/s1
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n/an/a 1.09E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430484
PNG
(CHEMBL2335535)
Show SMILES CCCCCCS(=O)c1cc(O)c2ccccc2c1
Show InChI InChI=1S/C16H20O2S/c1-2-3-4-7-10-19(18)14-11-13-8-5-6-9-15(13)16(17)12-14/h5-6,8-9,11-12,17H,2-4,7,10H2,1H3
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n/an/a 1.15E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430490
PNG
(CHEMBL2335530)
Show SMILES CCCCCCCCCCCCCCCCCCS(=O)(=O)C1=CC(=O)c2c(OC)ccc(OC)c2C1=O
Show InChI InChI=1S/C30H46O6S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-37(33,34)27-23-24(31)28-25(35-2)20-21-26(36-3)29(28)30(27)32/h20-21,23H,4-19,22H2,1-3H3
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n/an/a 1.29E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430505
PNG
(CHEMBL2335565)
Show SMILES CCCCCCCCCCCCCC=CS(=O)c1cc(O)c2c(OC)ccc(OC)c2c1O
Show InChI InChI=1S/C27H40O5S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19-33(30)24-20-21(28)25-22(31-2)17-18-23(32-3)26(25)27(24)29/h16-20,28-29H,4-15H2,1-3H3
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n/an/a 1.37E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430510
PNG
(CHEMBL2335560)
Show SMILES CCCCCCC=CS(=O)c1cc(O)c2c(OC)ccc(OC)c2c1O
Show InChI InChI=1S/C20H26O5S/c1-4-5-6-7-8-9-12-26(23)17-13-14(21)18-15(24-2)10-11-16(25-3)19(18)20(17)22/h9-13,21-22H,4-8H2,1-3H3
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n/an/a 1.41E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430511
PNG
(CHEMBL2335559)
Show SMILES CCCCCC=CS(=O)c1cc(O)c2c(OC)ccc(OC)c2c1O
Show InChI InChI=1S/C19H24O5S/c1-4-5-6-7-8-11-25(22)16-12-13(20)17-14(23-2)9-10-15(24-3)18(17)19(16)21/h8-12,20-21H,4-7H2,1-3H3
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n/an/a 1.65E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430474
PNG
(CHEMBL2335544)
Show SMILES Oc1cc(c(O)c2ccccc12)S(=O)C=C
Show InChI InChI=1S/C12H10O3S/c1-2-16(15)11-7-10(13)8-5-3-4-6-9(8)12(11)14/h2-7,13-14H,1H2
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n/an/a 1.78E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430494
PNG
(CHEMBL2335526)
Show SMILES CCCCCCCCCCS(=O)(=O)C1=CC(=O)c2c(OC)ccc(OC)c2C1=O
Show InChI InChI=1S/C22H30O6S/c1-4-5-6-7-8-9-10-11-14-29(25,26)19-15-16(23)20-17(27-2)12-13-18(28-3)21(20)22(19)24/h12-13,15H,4-11,14H2,1-3H3
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n/an/a 1.96E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430512
PNG
(CHEMBL2335558)
Show SMILES CCCCC=CS(=O)c1cc(O)c2c(OC)ccc(OC)c2c1O
Show InChI InChI=1S/C18H22O5S/c1-4-5-6-7-10-24(21)15-11-12(19)16-13(22-2)8-9-14(23-3)17(16)18(15)20/h7-11,19-20H,4-6H2,1-3H3
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n/an/a 2.05E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430495
PNG
(CHEMBL2335525)
Show SMILES CCCCCCCCCS(=O)(=O)C1=CC(=O)c2c(OC)ccc(OC)c2C1=O
Show InChI InChI=1S/C21H28O6S/c1-4-5-6-7-8-9-10-13-28(24,25)18-14-15(22)19-16(26-2)11-12-17(27-3)20(19)21(18)23/h11-12,14H,4-10,13H2,1-3H3
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n/an/a 2.18E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430461
PNG
(CHEMBL2335513)
Show SMILES CCCCCCCCCCCCSC1=CC(=O)c2c(OC)ccc(OC)c2C1=O
Show InChI InChI=1S/C24H34O4S/c1-4-5-6-7-8-9-10-11-12-13-16-29-21-17-18(25)22-19(27-2)14-15-20(28-3)23(22)24(21)26/h14-15,17H,4-13,16H2,1-3H3
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n/an/a 2.28E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430514
PNG
(CHEMBL2335556)
Show SMILES CCC=CS(=O)c1cc(O)c2c(OC)ccc(OC)c2c1O
Show InChI InChI=1S/C16H18O5S/c1-4-5-8-22(19)13-9-10(17)14-11(20-2)6-7-12(21-3)15(14)16(13)18/h5-9,17-18H,4H2,1-3H3
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n/an/a 2.33E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430513
PNG
(CHEMBL2335557)
Show SMILES CCCC=CS(=O)c1cc(O)c2c(OC)ccc(OC)c2c1O
Show InChI InChI=1S/C17H20O5S/c1-4-5-6-9-23(20)14-10-11(18)15-12(21-2)7-8-13(22-3)16(15)17(14)19/h6-10,18-19H,4-5H2,1-3H3
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n/an/a 2.47E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430471
PNG
(CHEMBL2335547)
Show SMILES CCCC=CS(=O)c1cc(O)c2ccccc2c1O
Show InChI InChI=1S/C15H16O3S/c1-2-3-6-9-19(18)14-10-13(16)11-7-4-5-8-12(11)15(14)17/h4-10,16-17H,2-3H2,1H3
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n/an/a 2.72E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430473
PNG
(CHEMBL2335545)
Show SMILES CC=CS(=O)c1cc(O)c2ccccc2c1O
Show InChI InChI=1S/C13H12O3S/c1-2-7-17(16)12-8-11(14)9-5-3-4-6-10(9)13(12)15/h2-8,14-15H,1H3
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n/an/a 2.76E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430499
PNG
(CHEMBL2335521)
Show SMILES CCCCCS(=O)(=O)C1=CC(=O)c2c(OC)ccc(OC)c2C1=O
Show InChI InChI=1S/C17H20O6S/c1-4-5-6-9-24(20,21)14-10-11(18)15-12(22-2)7-8-13(23-3)16(15)17(14)19/h7-8,10H,4-6,9H2,1-3H3
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n/an/a 2.87E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430472
PNG
(CHEMBL2335546)
Show SMILES CCC=CS(=O)c1cc(O)c2ccccc2c1O
Show InChI InChI=1S/C14H14O3S/c1-2-3-8-18(17)13-9-12(15)10-6-4-5-7-11(10)14(13)16/h3-9,15-16H,2H2,1H3
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n/an/a 3.32E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430470
PNG
(CHEMBL2335548)
Show SMILES CCCCC=CS(=O)c1cc(O)c2ccccc2c1O
Show InChI InChI=1S/C16H18O3S/c1-2-3-4-7-10-20(19)15-11-14(17)12-8-5-6-9-13(12)16(15)18/h5-11,17-18H,2-4H2,1H3
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n/an/a 4.15E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430464
PNG
(CHEMBL2335515)
Show SMILES CCCCCCCCCCC=CS(=O)c1cc(O)c2ccccc2c1O
Show InChI InChI=1S/C22H30O3S/c1-2-3-4-5-6-7-8-9-10-13-16-26(25)21-17-20(23)18-14-11-12-15-19(18)22(21)24/h11-17,23-24H,2-10H2,1H3
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n/an/a 4.15E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430469
PNG
(CHEMBL2335549)
Show SMILES CCCCCC=CS(=O)c1cc(O)c2ccccc2c1O
Show InChI InChI=1S/C17H20O3S/c1-2-3-4-5-8-11-21(20)16-12-15(18)13-9-6-7-10-14(13)17(16)19/h6-12,18-19H,2-5H2,1H3
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n/an/a 4.47E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430500
PNG
(CHEMBL2335520)
Show SMILES CCCCS(=O)(=O)C1=CC(=O)c2c(OC)ccc(OC)c2C1=O
Show InChI InChI=1S/C16H18O6S/c1-4-5-8-23(19,20)13-9-10(17)14-11(21-2)6-7-12(22-3)15(14)16(13)18/h6-7,9H,4-5,8H2,1-3H3
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n/an/a 4.50E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430468
PNG
(CHEMBL2335550)
Show SMILES CCCCCCC=CS(=O)c1cc(O)c2ccccc2c1O
Show InChI InChI=1S/C18H22O3S/c1-2-3-4-5-6-9-12-22(21)17-13-16(19)14-10-7-8-11-15(14)18(17)20/h7-13,19-20H,2-6H2,1H3
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n/an/a 4.61E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430496
PNG
(CHEMBL2335524)
Show SMILES CCCCCCCCS(=O)(=O)C1=CC(=O)c2c(OC)ccc(OC)c2C1=O
Show InChI InChI=1S/C20H26O6S/c1-4-5-6-7-8-9-12-27(23,24)17-13-14(21)18-15(25-2)10-11-16(26-3)19(18)20(17)22/h10-11,13H,4-9,12H2,1-3H3
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n/an/a 4.84E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430497
PNG
(CHEMBL2335523)
Show SMILES CCCCCCCS(=O)(=O)C1=CC(=O)c2c(OC)ccc(OC)c2C1=O
Show InChI InChI=1S/C19H24O6S/c1-4-5-6-7-8-11-26(22,23)16-12-13(20)17-14(24-2)9-10-15(25-3)18(17)19(16)21/h9-10,12H,4-8,11H2,1-3H3
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n/an/a 5.35E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430515
PNG
(CHEMBL2335555)
Show SMILES COc1ccc(OC)c2c(O)c(cc(O)c12)S(=O)C=CC
Show InChI InChI=1S/C15H16O5S/c1-4-7-21(18)12-8-9(16)13-10(19-2)5-6-11(20-3)14(13)15(12)17/h4-8,16-17H,1-3H3
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n/an/a 5.51E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430463
PNG
(CHEMBL2335516)
Show SMILES CCCCCCCCCCCCCC=CS(=O)c1cc(O)c2ccccc2c1O
Show InChI InChI=1S/C25H36O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-19-29(28)24-20-23(26)21-17-14-15-18-22(21)25(24)27/h14-20,26-27H,2-13H2,1H3
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n/an/a 5.66E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430498
PNG
(CHEMBL2335522)
Show SMILES CCCCCCS(=O)(=O)C1=CC(=O)c2c(OC)ccc(OC)c2C1=O
Show InChI InChI=1S/C18H22O6S/c1-4-5-6-7-10-25(21,22)15-11-12(19)16-13(23-2)8-9-14(24-3)17(16)18(15)20/h8-9,11H,4-7,10H2,1-3H3
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n/an/a 6.25E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430466
PNG
(CHEMBL2335552)
Show SMILES CCCCCCCCC=CS(=O)c1cc(O)c2ccccc2c1O
Show InChI InChI=1S/C20H26O3S/c1-2-3-4-5-6-7-8-11-14-24(23)19-15-18(21)16-12-9-10-13-17(16)20(19)22/h9-15,21-22H,2-8H2,1H3
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n/an/a 7.94E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430516
PNG
(CHEMBL2335554)
Show SMILES COc1ccc(OC)c2c(O)c(cc(O)c12)S(=O)C=C
Show InChI InChI=1S/C14H14O5S/c1-4-20(17)11-7-8(15)12-9(18-2)5-6-10(19-3)13(12)14(11)16/h4-7,15-16H,1H2,2-3H3
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n/an/a 8.32E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430465
PNG
(CHEMBL2335514)
Show SMILES CCCCCCCCCC=CS(=O)c1cc(O)c2ccccc2c1O
Show InChI InChI=1S/C21H28O3S/c1-2-3-4-5-6-7-8-9-12-15-25(24)20-16-19(22)17-13-10-11-14-18(17)21(20)23/h10-16,22-23H,2-9H2,1H3
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n/an/a 8.63E+4n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430502
PNG
(CHEMBL2335518)
Show SMILES CCS(=O)(=O)C1=CC(=O)c2c(OC)ccc(OC)c2C1=O
Show InChI InChI=1S/C14H14O6S/c1-4-21(17,18)11-7-8(15)12-9(19-2)5-6-10(20-3)13(12)14(11)16/h5-7H,4H2,1-3H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430501
PNG
(CHEMBL2335519)
Show SMILES CCCS(=O)(=O)C1=CC(=O)c2c(OC)ccc(OC)c2C1=O
Show InChI InChI=1S/C15H16O6S/c1-4-7-22(18,19)12-8-9(16)13-10(20-2)5-6-11(21-3)14(13)15(12)17/h5-6,8H,4,7H2,1-3H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430517
PNG
(CHEMBL2335553)
Show SMILES COc1ccc(OC)c2C(=O)C(=CC(=O)c12)S(C)=O
Show InChI InChI=1S/C13H12O5S/c1-17-8-4-5-9(18-2)12-11(8)7(14)6-10(13(12)15)19(3)16/h4-6H,1-3H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430504
PNG
(CHEMBL2335566)
Show SMILES CCCCCCCCCCCCCCCCC=CS(=O)c1cc(O)c2c(OC)ccc(OC)c2c1O
Show InChI InChI=1S/C30H46O5S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-36(33)27-23-24(31)28-25(34-2)20-21-26(35-3)29(28)30(27)32/h19-23,31-32H,4-18H2,1-3H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
Acyl Cholesterol Acyltransferase 1 (ACAT-1)


(Homo sapiens (human))
BDBM50430503
PNG
(CHEMBL2335567)
Show SMILES COc1ccc(OC)c2C(=O)C(=CC(=O)c12)S(C)(=O)=O
Show InChI InChI=1S/C13H12O6S/c1-18-8-4-5-9(19-2)12-11(8)7(14)6-10(13(12)15)20(3,16)17/h4-6H,1-3H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



Dongguk University-Seoul

Curated by ChEMBL


Assay Description
Inhibition of human macrophage ACAT expressed in human HepG2 cells using [14C]oleoyl-CoA as substrate incubated for 20 mins prior to substrate additi...


Eur J Med Chem 62: 515-25 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.020
BindingDB Entry DOI: 10.7270/Q29G5P5N
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%