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11 similar compounds to monomer 50297003

Compile data set for download or QSAR
Wt: 358.5
BDBM50263150
Wt: 416.5
BDBM50263194
Wt: 387.6
BDBM50263196
Wt: 288.4
BDBM50297004
Wt: 302.4
BDBM50297005
Wt: 316.4
BDBM50297006
Wt: 330.5
BDBM50297007
Wt: 344.5
BDBM50297008
Wt: 386.6
BDBM50297009
Wt: 414.6
BDBM50297010
Wt: 260.3
BDBM50297002

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 12 hits for monomerid = 50263150,50263194,50263196,50297004,50297005,50297006,50297007,50297008,50297009,50297010,50297002   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Sterol O-acyltransferase 1


(Homo sapiens (Human))
BDBM50263196
PNG
(CHEMBL478015 | N-(5-Aminomethyl-4,6-dimethyl-1-oct...)
Show SMILES CCCCCCCCN1CCc2c1c(NC(=O)C(C)(C)C)c(C)c(CN)c2C
Show InChI InChI=1S/C24H41N3O/c1-7-8-9-10-11-12-14-27-15-13-19-17(2)20(16-25)18(3)21(22(19)27)26-23(28)24(4,5)6/h7-16,25H2,1-6H3,(H,26,28)
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n/an/a 330n/an/an/an/an/an/a



Kyoto Pharmaceutical Industries

Curated by ChEMBL


Assay Description
Inhibition of ACAT-mediated esterified cholesterol accumulation in human THP1 cells exposed to acetyl-LDL during differentiation assessed as effect o...


J Med Chem 51: 4823-33 (2008)


Article DOI: 10.1021/jm800248r
BindingDB Entry DOI: 10.7270/Q2VT1RX7
More data for this
Ligand-Target Pair
Sterol O-acyltransferase 1


(Homo sapiens (Human))
BDBM50263194
PNG
(10-[7-(2,2-Dimethylpropanamido)-4,6-dimethylindoli...)
Show SMILES Cc1cc(C)c(NC(=O)C(C)(C)C)c2N(CCCCCCCCCC(O)=O)CCc12
Show InChI InChI=1S/C25H40N2O3/c1-18-17-19(2)22(26-24(30)25(3,4)5)23-20(18)14-16-27(23)15-12-10-8-6-7-9-11-13-21(28)29/h17H,6-16H2,1-5H3,(H,26,30)(H,28,29)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Kyoto Pharmaceutical Industries

Curated by ChEMBL


Assay Description
Inhibition of ACAT-mediated esterified cholesterol accumulation in human THP1 cells exposed to acetyl-LDL during differentiation assessed as effect o...


J Med Chem 51: 4823-33 (2008)


Article DOI: 10.1021/jm800248r
BindingDB Entry DOI: 10.7270/Q2VT1RX7
More data for this
Ligand-Target Pair
Sterol O-acyltransferase 1


(Homo sapiens (Human))
BDBM50263150
PNG
(CHEMBL513892 | N-(4,6-dimethyl-1-octylindolin-7-yl...)
Show SMILES CCCCCCCCN1CCc2c1c(NC(=O)C(C)(C)C)c(C)cc2C
Show InChI InChI=1S/C23H38N2O/c1-7-8-9-10-11-12-14-25-15-13-19-17(2)16-18(3)20(21(19)25)24-22(26)23(4,5)6/h16H,7-15H2,1-6H3,(H,24,26)
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n/an/a 640n/an/an/an/an/an/a



Kyoto Pharmaceutical Industries

Curated by ChEMBL


Assay Description
Inhibition of ACAT-mediated esterified cholesterol accumulation in human THP1 cells exposed to acetyl-LDL during differentiation assessed as effect o...


J Med Chem 51: 4823-33 (2008)


Article DOI: 10.1021/jm800248r
BindingDB Entry DOI: 10.7270/Q2VT1RX7
More data for this
Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase


(Oryctolagus cuniculus)
BDBM50297002
PNG
(CHEMBL564833 | N-(1,4,6-trimethylindolin-7-yl)piva...)
Show SMILES CN1CCc2c1c(NC(=O)C(C)(C)C)c(C)cc2C
Show InChI InChI=1S/C16H24N2O/c1-10-9-11(2)13(17-15(19)16(3,4)5)14-12(10)7-8-18(14)6/h9H,7-8H2,1-6H3,(H,17,19)
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n/an/a 3.10E+4n/an/an/an/an/an/a



Kyoto Pharmaceutical Industries

Curated by ChEMBL


Assay Description
Inhibition of ACAT in Japanese White rabbit liver microsomes


Bioorg Med Chem 17: 6020-31 (2009)


Article DOI: 10.1016/j.bmc.2009.06.047
BindingDB Entry DOI: 10.7270/Q2222TTC
More data for this
Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase


(Oryctolagus cuniculus)
BDBM50297004
PNG
(CHEMBL554163 | N-(4,6-dimethyl-1-propylindolin-7-y...)
Show SMILES CCCN1CCc2c1c(NC(=O)C(C)(C)C)c(C)cc2C
Show InChI InChI=1S/C18H28N2O/c1-7-9-20-10-8-14-12(2)11-13(3)15(16(14)20)19-17(21)18(4,5)6/h11H,7-10H2,1-6H3,(H,19,21)
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n/an/a 570n/an/an/an/an/an/a



Kyoto Pharmaceutical Industries

Curated by ChEMBL


Assay Description
Inhibition of ACAT in Japanese White rabbit liver microsomes


Bioorg Med Chem 17: 6020-31 (2009)


Article DOI: 10.1016/j.bmc.2009.06.047
BindingDB Entry DOI: 10.7270/Q2222TTC
More data for this
Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase


(Oryctolagus cuniculus)
BDBM50297010
PNG
(CHEMBL561477 | N-(1-dodecyl-4,6-dimethylindolin-7-...)
Show SMILES CCCCCCCCCCCCN1CCc2c1c(NC(=O)C(C)(C)C)c(C)cc2C
Show InChI InChI=1S/C27H46N2O/c1-7-8-9-10-11-12-13-14-15-16-18-29-19-17-23-21(2)20-22(3)24(25(23)29)28-26(30)27(4,5)6/h20H,7-19H2,1-6H3,(H,28,30)
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n/an/a 58n/an/an/an/an/an/a



Kyoto Pharmaceutical Industries

Curated by ChEMBL


Assay Description
Inhibition of ACAT in Japanese White rabbit liver microsomes


Bioorg Med Chem 17: 6020-31 (2009)


Article DOI: 10.1016/j.bmc.2009.06.047
BindingDB Entry DOI: 10.7270/Q2222TTC
More data for this
Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase


(Oryctolagus cuniculus)
BDBM50297006
PNG
(CHEMBL563443 | N-(4,6-dimethyl-1-pentylindolin-7-y...)
Show SMILES CCCCCN1CCc2c1c(NC(=O)C(C)(C)C)c(C)cc2C
Show InChI InChI=1S/C20H32N2O/c1-7-8-9-11-22-12-10-16-14(2)13-15(3)17(18(16)22)21-19(23)20(4,5)6/h13H,7-12H2,1-6H3,(H,21,23)
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n/an/a 110n/an/an/an/an/an/a



Kyoto Pharmaceutical Industries

Curated by ChEMBL


Assay Description
Inhibition of ACAT in Japanese White rabbit liver microsomes


Bioorg Med Chem 17: 6020-31 (2009)


Article DOI: 10.1016/j.bmc.2009.06.047
BindingDB Entry DOI: 10.7270/Q2222TTC
More data for this
Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase


(Oryctolagus cuniculus)
BDBM50297007
PNG
(CHEMBL561074 | N-(1-hexyl-4,6-dimethylindolin-7-yl...)
Show SMILES CCCCCCN1CCc2c1c(NC(=O)C(C)(C)C)c(C)cc2C
Show InChI InChI=1S/C21H34N2O/c1-7-8-9-10-12-23-13-11-17-15(2)14-16(3)18(19(17)23)22-20(24)21(4,5)6/h14H,7-13H2,1-6H3,(H,22,24)
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n/an/a 67n/an/an/an/an/an/a



Kyoto Pharmaceutical Industries

Curated by ChEMBL


Assay Description
Inhibition of ACAT in Japanese White rabbit liver microsomes


Bioorg Med Chem 17: 6020-31 (2009)


Article DOI: 10.1016/j.bmc.2009.06.047
BindingDB Entry DOI: 10.7270/Q2222TTC
More data for this
Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase


(Oryctolagus cuniculus)
BDBM50297008
PNG
(CHEMBL558454 | N-(1-heptyl-4,6-dimethylindolin-7-y...)
Show SMILES CCCCCCCN1CCc2c1c(NC(=O)C(C)(C)C)c(C)cc2C
Show InChI InChI=1S/C22H36N2O/c1-7-8-9-10-11-13-24-14-12-18-16(2)15-17(3)19(20(18)24)23-21(25)22(4,5)6/h15H,7-14H2,1-6H3,(H,23,25)
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n/an/a 30n/an/an/an/an/an/a



Kyoto Pharmaceutical Industries

Curated by ChEMBL


Assay Description
Inhibition of ACAT in Japanese White rabbit liver microsomes


Bioorg Med Chem 17: 6020-31 (2009)


Article DOI: 10.1016/j.bmc.2009.06.047
BindingDB Entry DOI: 10.7270/Q2222TTC
More data for this
Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase


(Oryctolagus cuniculus)
BDBM50263150
PNG
(CHEMBL513892 | N-(4,6-dimethyl-1-octylindolin-7-yl...)
Show SMILES CCCCCCCCN1CCc2c1c(NC(=O)C(C)(C)C)c(C)cc2C
Show InChI InChI=1S/C23H38N2O/c1-7-8-9-10-11-12-14-25-15-13-19-17(2)16-18(3)20(21(19)25)24-22(26)23(4,5)6/h16H,7-15H2,1-6H3,(H,24,26)
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n/an/a 24n/an/an/an/an/an/a



Kyoto Pharmaceutical Industries

Curated by ChEMBL


Assay Description
Inhibition of ACAT in Japanese White rabbit liver microsomes


Bioorg Med Chem 17: 6020-31 (2009)


Article DOI: 10.1016/j.bmc.2009.06.047
BindingDB Entry DOI: 10.7270/Q2222TTC
More data for this
Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase


(Oryctolagus cuniculus)
BDBM50297009
PNG
(CHEMBL550526 | N-(1-decyl-4,6-dimethylindolin-7-yl...)
Show SMILES CCCCCCCCCCN1CCc2c1c(NC(=O)C(C)(C)C)c(C)cc2C
Show InChI InChI=1S/C25H42N2O/c1-7-8-9-10-11-12-13-14-16-27-17-15-21-19(2)18-20(3)22(23(21)27)26-24(28)25(4,5)6/h18H,7-17H2,1-6H3,(H,26,28)
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n/an/a 27n/an/an/an/an/an/a



Kyoto Pharmaceutical Industries

Curated by ChEMBL


Assay Description
Inhibition of ACAT in Japanese White rabbit liver microsomes


Bioorg Med Chem 17: 6020-31 (2009)


Article DOI: 10.1016/j.bmc.2009.06.047
BindingDB Entry DOI: 10.7270/Q2222TTC
More data for this
Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase


(Oryctolagus cuniculus)
BDBM50297005
PNG
(CHEMBL538381 | N-(1-butyl-4,6-dimethylindolin-7-yl...)
Show SMILES CCCCN1CCc2c1c(NC(=O)C(C)(C)C)c(C)cc2C
Show InChI InChI=1S/C19H30N2O/c1-7-8-10-21-11-9-15-13(2)12-14(3)16(17(15)21)20-18(22)19(4,5)6/h12H,7-11H2,1-6H3,(H,20,22)
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n/an/a 220n/an/an/an/an/an/a



Kyoto Pharmaceutical Industries

Curated by ChEMBL


Assay Description
Inhibition of ACAT in Japanese White rabbit liver microsomes


Bioorg Med Chem 17: 6020-31 (2009)


Article DOI: 10.1016/j.bmc.2009.06.047
BindingDB Entry DOI: 10.7270/Q2222TTC
More data for this
Ligand-Target Pair