Inhibitors | Comment | Organism | Structure |
---|---|---|---|
(2,4-dihydroxyphenyl)[3-(1-[hydroxy[(3,4,5-trihydroxyphenyl)methyl]amino]ethyl)phenyl]methanone | - |
Homo sapiens | |
(2,4-dihydroxyphenyl)[3-(1-[hydroxy[(4-hydroxyphenyl)methyl]amino]ethyl)phenyl]methanone | - |
Homo sapiens | |
2-(3-acetylphenyl)propanoic acid | - |
Homo sapiens | |
2-(3-benzoylphenyl)propanoic acid | - |
Homo sapiens | |
2-(3-phenoxyphenyl)propanoic acid | - |
Homo sapiens | |
2-methyl-3-[(morpholine-4-carbonyl)amino]-3-oxopropanoic acid | - |
Homo sapiens | |
2-[3-(2-methylpropanoyl)phenyl]propanoic acid | - |
Homo sapiens | |
2-[3-(morpholine-4-carbonyl)phenyl]propanoic acid | - |
Homo sapiens | |
2-[3-[(4-hydroxyphenyl)carbamoyl]phenyl]propanoic acid | - |
Homo sapiens | |
2-[3-[hydroxy(phenyl)amino]phenyl]propanoic acid | - |
Homo sapiens | |
2-[4'-[(morpholin-4-yl)sulfanyl][1,1'-biphenyl]-3-yl]propanoic acid | - |
Homo sapiens | |
2-[4-(morpholine-4-carbonyl)phenyl]propanoic acid | - |
Homo sapiens | |
3-(1-carboxyethyl)benzoic acid | - |
Homo sapiens | |
4-[(hydroxy[1-[3'-(morpholin-4-yl)[1,1'-biphenyl]-3-yl]ethyl]amino)methyl]phenol | - |
Homo sapiens | |
4-[[hydroxy(2-methyl-1-[3-[(morpholin-4-yl)oxy]phenyl]propyl)amino]methyl]phenol | - |
Homo sapiens | |
5-[[hydroxy(2-methyl-1-[3-[(morpholin-4-yl)oxy]phenyl]propyl)amino]methyl]benzene-1,2,3-triol | - |
Homo sapiens | |
arachidonate | substrate inhibition | Homo sapiens | |
additional information | synthesis and evaluation of inhibitors of 5-lipoxygenase catalytic activity based on 2-(3-methylphenyl)propanoic acid and 4-substituted morpholine derivatives, inhibitor molecular docking in the active site of 5-LOX, overview. 2-(3-benzoylphenyl)propanoic acid is an active component of the nonsteroidal antiinflammatory drug ketoprofen | Homo sapiens | |
[3-(1-[hydroxy[(3,4,5-trihydroxyphenyl)methyl]amino]ethyl)phenyl](morpholin-4-yl)methanone | - |
Homo sapiens | |
[3-(1-[hydroxy[(4-hydroxyphenyl)methyl]amino]ethyl)phenyl](morpholin-4-yl)methanone | - |
Homo sapiens | |
[3-(bromocarbonyl)phenyl](morpholin-4-yl)acetic acid | - |
Homo sapiens |
Metals/Ions | Comment | Organism | Structure |
---|---|---|---|
Fe2+ | a nonheme Fe2+ ion coordinated by three polar histidines H372, H550, and H367, the carbonyl group of N554, the carboxylic group of the C-terminal I673, and a water moleculein the active site, overview. On interaction with the active site, the ligands replaces the H2O molecule | Homo sapiens |
Natural Substrates | Organism | Comment (Nat. Sub.) | Natural Products | Comment (Nat. Pro.) | Rev. | Reac. |
---|---|---|---|---|---|---|
arachidonate + O2 | Homo sapiens | - |
(5S,6S,7E,9E,11Z,14Z)-5,6-epoxyicosa-7,9,11,14-tetraenoate + H2O | - |
? |
Organism | UniProt | Comment | Textmining |
---|---|---|---|
Homo sapiens | P09917 | - |
- |
Substrates | Comment Substrates | Organism | Products | Comment (Products) | Rev. | Reac. |
---|---|---|---|---|---|---|
arachidonate + O2 | - |
Homo sapiens | (5S,6S,7E,9E,11Z,14Z)-5,6-epoxyicosa-7,9,11,14-tetraenoate + H2O | - |
? |
Synonyms | Comment | Organism |
---|---|---|
5-lipoxygenase | - |
Homo sapiens |
5-LOX | - |
Homo sapiens |
Ki Value [mM] | Ki Value maximum [mM] | Inhibitor | Comment | Organism | Structure |
---|---|---|---|---|---|
0.00011 | - |
4-[[hydroxy(2-methyl-1-[3-[(morpholin-4-yl)oxy]phenyl]propyl)amino]methyl]phenol | pH and temperature not specified in the publication | Homo sapiens | |
0.00013 | - |
2-[4'-[(morpholin-4-yl)sulfanyl][1,1'-biphenyl]-3-yl]propanoic acid | pH and temperature not specified in the publication | Homo sapiens | |
0.00018 | - |
[3-(1-[hydroxy[(4-hydroxyphenyl)methyl]amino]ethyl)phenyl](morpholin-4-yl)methanone | pH and temperature not specified in the publication | Homo sapiens | |
0.00032 | - |
5-[[hydroxy(2-methyl-1-[3-[(morpholin-4-yl)oxy]phenyl]propyl)amino]methyl]benzene-1,2,3-triol | pH and temperature not specified in the publication | Homo sapiens | |
0.00042 | - |
2-[3-[(4-hydroxyphenyl)carbamoyl]phenyl]propanoic acid | pH and temperature not specified in the publication | Homo sapiens | |
0.00059 | - |
[3-(1-[hydroxy[(3,4,5-trihydroxyphenyl)methyl]amino]ethyl)phenyl](morpholin-4-yl)methanone | pH and temperature not specified in the publication | Homo sapiens | |
0.00071 | - |
(2,4-dihydroxyphenyl)[3-(1-[hydroxy[(3,4,5-trihydroxyphenyl)methyl]amino]ethyl)phenyl]methanone | pH and temperature not specified in the publication | Homo sapiens | |
0.0009 | - |
(2,4-dihydroxyphenyl)[3-(1-[hydroxy[(4-hydroxyphenyl)methyl]amino]ethyl)phenyl]methanone | pH and temperature not specified in the publication | Homo sapiens | |
0.00136 | - |
2-(3-benzoylphenyl)propanoic acid | pH and temperature not specified in the publication | Homo sapiens | |
0.00267 | - |
2-(3-phenoxyphenyl)propanoic acid | pH and temperature not specified in the publication | Homo sapiens | |
0.00515 | - |
4-[(hydroxy[1-[3'-(morpholin-4-yl)[1,1'-biphenyl]-3-yl]ethyl]amino)methyl]phenol | pH and temperature not specified in the publication | Homo sapiens | |
0.0057 | - |
2-[3-[hydroxy(phenyl)amino]phenyl]propanoic acid | pH and temperature not specified in the publication | Homo sapiens | |
0.00734 | - |
2-[3-(2-methylpropanoyl)phenyl]propanoic acid | pH and temperature not specified in the publication | Homo sapiens | |
0.00734 | - |
2-[3-(morpholine-4-carbonyl)phenyl]propanoic acid | pH and temperature not specified in the publication | Homo sapiens | |
0.0112 | - |
2-[4-(morpholine-4-carbonyl)phenyl]propanoic acid | pH and temperature not specified in the publication | Homo sapiens | |
0.016 | - |
2-(3-acetylphenyl)propanoic acid | pH and temperature not specified in the publication | Homo sapiens | |
0.0398 | - |
arachidonate | pH and temperature not specified in the publication | Homo sapiens | |
0.0398 | - |
[3-(bromocarbonyl)phenyl](morpholin-4-yl)acetic acid | pH and temperature not specified in the publication | Homo sapiens | |
0.0455 | - |
2-methyl-3-[(morpholine-4-carbonyl)amino]-3-oxopropanoic acid | pH and temperature not specified in the publication | Homo sapiens | |
0.17 | - |
3-(1-carboxyethyl)benzoic acid | pH and temperature not specified in the publication | Homo sapiens |
General Information | Comment | Organism |
---|---|---|
additional information | the active site of 5-LOX contains a nonheme Fe2+ ion coordinated by three polar histidines H372, H550, and H367, the carbonyl group of N554, the carboxylic group of the C-terminal I673, and a water molecule, modeling of the active site of 5-LOX. A hydrophobic cleft formed by nonpolar amino acids L414, I415, L368, L607, L420, F421, F177, A424, A410, A603, V604, and P569 can also play an important role in orientation of ligands in the active site of 5-LOX | Homo sapiens |