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Literature summary for 3.1.1.13 extracted from
- 5,6-Benzoflavones as cholesterol esterase inhibitors synthesis, biological evaluation and docking studies (2018), MedChemComm, 9, 490-502 .
Inhibitors
| Inhibitors | Comment | Organism | Structure |
|---|---|---|---|
| 3-(2,3-dichlorophenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens |  |
| 3-(2,4-difluorophenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(2,4-dimethoxyphenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(2,5-difluorophenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(2,6-difluorophenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(2-(trifluoromethyl)phenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(2-bromophenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(2-fluoro-4-(trifluoromethyl)phenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(2-fluoro-6-(trifluoromethyl)phenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(2-fluorophenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(2-iodophenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(3,4-difluorophenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(3,4-dimethoxyphenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(3,5-bis(trifluoromethyl)phenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(3,5-difluorophenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(3,5-dinitrophenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(3-(acetoxy)phenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(3-(chloromethyl)phenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(3-(trifluoromethyl)phenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(3-bromophenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(3-chlorophenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(3-fluoro-5-(trifluoromethyl)phenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(3-fluorophenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(3-nitrophenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(3-trifluoromethoxyphenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(4-(acetoxy)phenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(4-(chloromethyl)phenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(4-(dimethylamino)phenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(4-(trifluoromethyl)phenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(4-bromophenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(4-fluoro-2-(trifluoromethyl)phenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(4-fluoro-3-(trifluoromethyl)phenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(4-fluorophenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(4-iodophenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(4-methoxyphenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(4-nitrophenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(4-trifluoromethoxyphenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-(5-fluoro-2-(trifluoromethyl)phenyl)-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-p-tolyl-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| 3-phenyl-1H-benzo[f]chromen-1-one | - |
Homo sapiens | |
| additional information | 5,6-benzoflavones as cholesterol esterase inhibitors, synthesis, biological evaluation, and molecular docking studies. NMR structure analysis of the compounds. In silico absorption, distribution, metabolism, and excretion (ADME) properties of 5,6-benzoflavone derivatives, overview | Homo sapiens |
Organism
| Organism | UniProt | Comment | Textmining |
|---|---|---|---|
| Homo sapiens | P19835 | - |
- |
Source Tissue
| Source Tissue | Comment | Organism | Textmining |
|---|---|---|---|
| pancreas | - |
Homo sapiens | - |
Synonyms
| Synonyms | Comment | Organism |
|---|---|---|
| BAL | - |
Homo sapiens |
| bile-salt activated lipase | - |
Homo sapiens |
| CEase | - |
Homo sapiens |
| cel | - |
Homo sapiens |
| cholesterol esterase | - |
Homo sapiens |
| hCEase | - |
Homo sapiens |
IC50 Value
| IC50 Value | IC50 Value Maximum | Comment | Organism | Inhibitor | Structure |
|---|---|---|---|---|---|
| 0.00000073 | - |
pH and temperature not specified in the publication | Homo sapiens | 3-(2,3-dichlorophenyl)-1H-benzo[f]chromen-1-one | |
| 0.00000083 | - |
pH and temperature not specified in the publication | Homo sapiens | 3-(3-chlorophenyl)-1H-benzo[f]chromen-1-one | |
| 0.00000099 | - |
pH and temperature not specified in the publication | Homo sapiens | 3-(3,5-difluorophenyl)-1H-benzo[f]chromen-1-one | |
| 0.00000108 | - |
pH and temperature not specified in the publication | Homo sapiens | 3-(2,5-difluorophenyl)-1H-benzo[f]chromen-1-one | |
| 0.00000115 | - |
pH and temperature not specified in the publication | Homo sapiens | 3-(3,4-difluorophenyl)-1H-benzo[f]chromen-1-one | |
| 0.00000119 | - |
pH and temperature not specified in the publication | Homo sapiens | 3-(2,6-difluorophenyl)-1H-benzo[f]chromen-1-one | |
| 0.00000146 | - |
pH and temperature not specified in the publication | Homo sapiens | 3-(2,4-difluorophenyl)-1H-benzo[f]chromen-1-one | |
| 0.00000259 | - |
pH and temperature not specified in the publication | Homo sapiens | 3-(2-fluorophenyl)-1H-benzo[f]chromen-1-one | |
| 0.0000039 | - |
pH and temperature not specified in the publication | Homo sapiens | 3-(3-fluorophenyl)-1H-benzo[f]chromen-1-one | |
| 0.0000045 | - |
pH and temperature not specified in the publication | Homo sapiens | 3-(4-fluorophenyl)-1H-benzo[f]chromen-1-one | |
| 0.00000469 | - |
pH and temperature not specified in the publication | Homo sapiens | 3-(2-bromophenyl)-1H-benzo[f]chromen-1-one | |
| 0.00000601 | - |
pH and temperature not specified in the publication | Homo sapiens | 3-(3-bromophenyl)-1H-benzo[f]chromen-1-one | |
| 0.00000815 | - |
pH and temperature not specified in the publication | Homo sapiens | 3-(4-bromophenyl)-1H-benzo[f]chromen-1-one | |
| 0.00000955 | - |
pH and temperature not specified in the publication | Homo sapiens | 3-(2-iodophenyl)-1H-benzo[f]chromen-1-one | |
| 0.0000098 | - |
pH and temperature not specified in the publication | Homo sapiens | 3-(3,5-dinitrophenyl)-1H-benzo[f]chromen-1-one | |
| 0.00001311 | - |
pH and temperature not specified in the publication | Homo sapiens | 3-(4-iodophenyl)-1H-benzo[f]chromen-1-one | |
| 0.00001644 | - |
pH and temperature not specified in the publication | Homo sapiens | 3-(3-nitrophenyl)-1H-benzo[f]chromen-1-one | |
| 0.00001801 | - |
pH and temperature not specified in the publication | Homo sapiens | 3-(4-nitrophenyl)-1H-benzo[f]chromen-1-one | |
| 0.00002005 | - |
pH and temperature not specified in the publication | Homo sapiens | 3-(3-(chloromethyl)phenyl)-1H-benzo[f]chromen-1-one | |
| 0.00002223 | - |
pH and temperature not specified in the publication | Homo sapiens | 3-(4-(chloromethyl)phenyl)-1H-benzo[f]chromen-1-one | |
| 0.00002311 | - |
pH and temperature not specified in the publication | Homo sapiens | 3-(2-fluoro-4-(trifluoromethyl)phenyl)-1H-benzo[f]chromen-1-one | |
| 0.00002779 | - |
pH and temperature not specified in the publication | Homo sapiens | 3-(5-fluoro-2-(trifluoromethyl)phenyl)-1H-benzo[f]chromen-1-one | |
| 0.00002911 | - |
pH and temperature not specified in the publication | Homo sapiens | 3-(3-fluoro-5-(trifluoromethyl)phenyl)-1H-benzo[f]chromen-1-one | |
| 0.00002917 | - |
pH and temperature not specified in the publication | Homo sapiens | 3-(2-fluoro-6-(trifluoromethyl)phenyl)-1H-benzo[f]chromen-1-one | |
| 0.00003135 | - |
pH and temperature not specified in the publication | Homo sapiens | 3-(2-(trifluoromethyl)phenyl)-1H-benzo[f]chromen-1-one | |
| 0.00005106 | - |
pH and temperature not specified in the publication | Homo sapiens | 3-phenyl-1H-benzo[f]chromen-1-one | |
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