Target Poor or Non Binder(s) Information
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T93344 | Target Info | |||
| Target Name | Squalene monooxygenase (SQLE) | ||||
| Synonyms |
Squalene epoxidase; SQLE; SE; Oxidosqaulene cyclase
Click to Show/Hide
|
||||
| Target Type | Successful Target | ||||
| Gene Name | SQLE | ||||
| Biochemical Class | Paired donor oxygen oxidoreductase | ||||
| UniProt ID | |||||
| Poor Binders of This Target (in total, 4 binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
6,10,15,19,23-Pentamethyl-tetracosa-1,2,6,10,14,18,22-heptaene
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL69099; BDBM50018519
Click to Show/Hide
|
||||
| Activity |
IC50 = 60000 nM
|
[1] | |||
| Compound Name |
3-(2-Azidophenyl)-N-ethyl-N-[[3-[(4-thiophen-3-ylthiophen-2-yl)methoxy]phenyl]methyl]prop-2-yn-1-amine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL15811; BDBM50291662; [3-(2-Azido-phenyl)-prop-2-ynyl]-[3-([3,3'']bithiophenyl-5-ylmethoxy)-benzyl]-ethyl-amine
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[2] | |||
| Compound Name |
4,8,12,16-Octadecatetraen-1-ol, 4,9,13,17-tetramethyl-
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL47584; SCHEMBL16451625; BDBM50015505; 4,9,13,17-Tetramethyl-octadeca-4,8,12,16-tetraen-1-ol; (4E,8E,12E)-4,9,13,17-Tetramethyl-4,8,12,16-octadecatetraen-1-ol #; (4E,8E,12E)-4,9,13,17-Tetramethyl-4,8,12,16-octadecatetren-1-ol
Click to Show/Hide
|
||||
| Activity |
IC50 = 100000 nM
|
[3] | |||
| Compound Name |
(2Z,10E,14E)-6,11,15,19-Tetramethyl-2-(4-methylpent-3-enyl)icosa-2,6,10,14,18-pentaen-1-amine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL358117; BDBM50286538; 6,11,15,19-tetramethyl-2-(4-methyl-3-pentenyl)-(2Z,6E,10E,14E)-2,6,10,14,18-icosapentaen-1-amine
Click to Show/Hide
|
||||
| Activity |
IC50 = 109000 nM
|
[4] | |||
| Non Binders of This Target (in total, 15 non binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
(9E,13E,21E)-5,9,14,18,22-Pentamethyl-1-nitro-tricosa-5,9,13,17,21-pentaen-1-ol
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL27988; BDBM50281970
Click to Show/Hide
|
||||
| Activity |
IC50 = 270000 nM
|
[5] | |||
| Compound Name |
3,7,11,16,20,24-Hexamethyl-pentacosa-1,3,7,11,15,19,23-heptaene
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL69800; 1-Methylidenesqualene; BDBM50018521
Click to Show/Hide
|
||||
| Activity |
IC50 > 400000 nM
|
[1] | |||
| Compound Name |
6,10,15,19,23-Pentamethyl-tetracosa-6,10,14,18,22-pentaen-1-yn-3-ol
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL70015; BDBM50018524
Click to Show/Hide
|
||||
| Activity |
IC50 = 400000 nM
|
[1] | |||
| Compound Name |
1,1,22,22-Tetrachloro-5,9,14,18-tetramethyl-docosa-1,5,9,13,17,21-hexaene
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL68923; BDBM50018517
Click to Show/Hide
|
||||
| Activity |
IC50 > 400000 nM
|
[1] | |||
| Compound Name |
4,8,12,17,21,25-Hexamethyl-hexacosa-4,8,12,16,20,24-hexaen-1-ol
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL47413; SCHEMBL20449625; BDBM50015506; (4E,8E,12E,16E,20E)-4,8,12,17,21,25-Hexamethyl-4,8,12,16,20,24-hexacosahexen-1-ol; (4E,8E,12E,16E,20E)-4,8,12,17,21,25-hexamethylhexacosa-4,8,12,16,20,24-hexaen-1-ol
Click to Show/Hide
|
||||
| Activity |
IC50 > 400000 nM
|
[3] | |||
| Compound Name |
(1E,5E,9E,13E,17E)-5,9,14,18,22-Pentamethyl-1-nitro-tricosa-1,5,9,13,17,21-hexaene
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL24859; BDBM50281969
Click to Show/Hide
|
||||
| Activity |
IC50 > 400000 nM
|
[5] | |||
| Compound Name |
5,9,14,18-Tetramethyl-docosa-5,9,13,17-tetraene-1,21-diyne
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL69598; BDBM50018523
Click to Show/Hide
|
||||
| Activity |
IC50 > 400000 nM
|
[1] | |||
| Compound Name |
(4,8,13,17,21-Pentamethyl-docosa-4,8,12,16,20-pentaenylidene)-cyclopropane
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL66984; BDBM50018526
Click to Show/Hide
|
||||
| Activity |
IC50 > 400000 nM
|
[1] | |||
| Compound Name |
(1,5,9,14,18,22-Hexamethyl-tricosa-1,5,9,13,17,21-hexaenyl)-cyclopropane
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL69061; BDBM50018516
Click to Show/Hide
|
||||
| Activity |
IC50 > 400000 nM
|
[1] | |||
| Compound Name |
4,8,12-Tetradecatrien-1-ol, 5,9,13-trimethyl-
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL48139; SCHEMBL8625008; SCHEMBL8625012; SCHEMBL16221426; (4E,8E)-5,9,13-trimethyltetradeca-4,8,12-trien-1-ol; BDBM50015504; ZINC29413145; 5,9,13-Trimethyl-4,8,12-tetradecatriene-1-ol; 5,9,13-Trimethyl-tetradeca-4,8,12-trien-1-ol; (4E,8E)-5,9,13-Trimethyl-4,8,12-tetradecatrien-1-ol; (4E,8E)-5,9,13-Trimethyl-4,8,12-tetradecatrien-1-ol #
Click to Show/Hide
|
||||
| Activity |
IC50 > 400000 nM
|
[3] | |||
| Compound Name |
6,10,15,19-Tetramethyl-tetracosa-6,10,14,18-tetraene-1,23-diyne-3,22-diol
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL67458; BDBM50018522
Click to Show/Hide
|
||||
| Activity |
IC50 > 400000 nM
|
[1] | |||
| Compound Name |
2-[Ethyl-[[3-[(4-thiophen-2-ylthiophen-2-yl)methoxy]phenyl]methyl]amino]-4-[3-(trifluoromethyl)diazirin-3-yl]phenol
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL308348
Click to Show/Hide
|
||||
| Activity |
IC50 = 500000 nM
|
[6] | |||
| Compound Name |
[4-(Chloromethyl)phenyl]-[4-[ethyl-[[3-[(4-thiophen-2-ylthiophen-2-yl)methoxy]phenyl]methyl]amino]phenyl]methanone
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL305265; BDBM50283106
Click to Show/Hide
|
||||
| Activity |
IC50 = 500000 nM
|
[6] | |||
| Compound Name |
3-[Ethyl-[[3-[(4-thiophen-2-ylthiophen-2-yl)methoxy]phenyl]methyl]amino]-5-[3-(trifluoromethyl)diazirin-3-yl]phenol
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL71202
Click to Show/Hide
|
||||
| Activity |
IC50 = 500000 nM
|
[6] | |||
| Compound Name |
[3-[[3-[[[(E)-6,6-Dimethylhept-2-en-4-ynyl]-ethylamino]methyl]phenoxy]methyl]-5-[3-(trifluoromethyl)diazirin-3-yl]phenyl]methanol
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL304796
Click to Show/Hide
|
||||
| Activity |
IC50 = 500000 nM
|
[6] | |||
| Click to Show/Hide the Information of All Non Binders | |||||
| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Squalene analogues containing isopropylidene mimics as potential inhibitors of pig liver squalene epoxidase and oxidosqualene cyclase. J Med Chem. 1989 Sep;32(9):2152-8. | ||||
| REF 2 | Design and synthesis of new potential photoaffinity labels for mammalian squalene epoxidase. Bioorg Med Chem Lett. 1997 May 6;7(9):1153-6. | ||||
| REF 3 | Inhibition of vertebrate squalene epoxidase by extended and truncated analogues of trisnorsqualene alcohol. J Med Chem. 1990 Jun;33(6):1698-701. | ||||
| REF 4 | Purification of pig and rat liver squalene epoxidase by affinity chromatography. Bioorg Med Chem Lett. 1995 Mar 2;5(5):481-6. | ||||
| REF 5 | Trisnorsqualene methyl hydroxylamine: a potent dual inhibitor of mammalian squalene epoxidase and oxidosqualene cyclase. Bioorg Med Chem Lett. 1993 Jun;3(6):1319-22. | ||||
| REF 6 | Novel non-squalenoid photoaffinity labels for mammalian squalene epoxidase. Bioorg Med Chem Lett. 1994 Sep 22;4(18):2179-84. | ||||
If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.