Target Poor or Non Binder(s) Information
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T63484 | Target Info | |||
| Target Name | Glucose-6-phosphate dehydrogenase (G6PD) | ||||
| Synonyms |
Glucose-6-phosphate 1-dehydrogenase
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|
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| Target Type | Successful Target | ||||
| Gene Name | G6PD | ||||
| Biochemical Class | CH-OH donor oxidoreductase | ||||
| UniProt ID | |||||
| Poor Binders of This Target (in total, 51 binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
ALLOPREGNANOLONE
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|
approved | Compound Info | ||
| Synonyms |
516-54-1; Brexanolone; Allotetrahydroprogesterone; Allopregnan-3alpha-ol-20-one; 3alpha-hydroxy-5alpha-pregnan-20-one; SAGE-547; UNII-S39XZ5QV8Y; 3-alpha,5-alpha-Pregnanolone; 3alpha-OH DHP; 3alpha,5alpha-THP; 5alpha-Pregnan-3alpha-ol-20-one; 3a-Hydroxy-5a-pregnan-20-one; 3a,5a-THP; (3alpha)-Allopregnanolone; 3-alpha,5-alpha-Tetrahydroprogesterone; BRN 3211363; S39XZ5QV8Y; 3alpha-Hydroxy-5alpha-dihydroprogesterone; 3-alpha-Hydroxy-5-alpha-pregnan-20-one; CHEMBL207538; CHEBI:50169; SGE-102
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|
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| Activity |
IC50 = 66000 nM
|
[1] | |||
| Compound Name |
Pregnenolone
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|
Phase 4 | Compound Info | ||
| Synonyms |
Pregnenolone (schizophrenia); Neurosteroid (schizophrenia), Neuroscience; Pregnenolone (schizophrenia), Neuroscience
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|
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| Activity |
IC50 = 81400 nM
|
[1] | |||
| Compound Name |
N-[(3S,5S,8R,9S,10S,13S,14S)-10,13-Dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl]ethanesulfonamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2057298; BDBM50388499
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|
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| Activity |
IC50 = 70500 nM
|
[1] | |||
| Compound Name |
(2Z)-N-[2-(Azepan-1-yl)ethyl]-2-[(2-fluorophenyl)methylidene]-3-oxo-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170918; BDBM50396496
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|
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| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-N-[(1-Ethylpyrrolidin-2-yl)methyl]-2-[(4-methylphenyl)methylidene]-3-oxo-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170930; BDBM50396487
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|
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| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-N-[2-(Dimethylamino)ethyl]-2-[(4-methoxyphenyl)methylidene]-3-oxo-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170921; BDBM50396510
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|
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| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(Z)-N-(2-(Diethylamino)ethyl)-2-(2-fluorobenzylidene)-3-oxo-3,4-dihydro-2H-benzo[b][1,4]thiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170923; MLS003876172; BDBM50396508; SMR002533127; MLS-0469640.0001
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|
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| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-2-[(2-Fluorophenyl)methylidene]-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170909; BDBM50396492; MLS-0466793.0001
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|
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| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(Z)-N-((1-Ethylpyrrolidin-2-yl)methyl)-2-(2-methylbenzylidene)-3-oxo-3,4-dihydro-2H-benzo[b][1,4]thiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170933; MLS003876173; BDBM50396524; SMR002533128; MLS-0466772.0001
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|
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| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(R,Z)-N-((1-Ethylpyrrolidin-2-yl)methyl)-2-(2-fluorobenzylidene)-3-oxo-3,4-dihydro-2H-benzo[b][1,4]thiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170943; MLS003876169; ML276; BDBM50396489; NCGC00386839-01; SMR002533124; MLS-0466749.0001; MLS-0466749.0002
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|
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| Activity |
IC50 ~ 80000 nM
|
[3] | |||
| Compound Name |
(2Z)-2-[(2-Fluorophenyl)methylidene]-3-oxo-N-(2-pyrrolidin-1-ylethyl)-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170912; BDBM50396502; MLS-0466786.0001
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|
||||
| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-N-[[2-(Dimethylamino)phenyl]methyl]-2-[(2-fluorophenyl)methylidene]-3-oxo-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2169897; BDBM50396485; MLS-0466796.0001
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|
||||
| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
N-[(1-Ethylpyrrolidin-2-yl)methyl]-2-[(2-fluorophenyl)methyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170942; BDBM50396526; MLS-0469635.0001
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|
||||
| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-2-[(2,3-Difluorophenyl)methylidene]-N-[(1-ethylpyrrolidin-2-yl)methyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170937; BDBM50396520; MLS-0469631.0001
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|
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| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-6-(3-Aminopyrrolidine-1-carbonyl)-2-[(2-fluorophenyl)methylidene]-4H-1,4-benzothiazin-3-one
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170910; BDBM50396491; MLS-0466795.0001
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|
||||
| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-2-Benzylidene-N-[2-(diethylamino)ethyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170922; ZINC3059488; BDBM50396509; AKOS002114624; MLS-0466619.0001
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|
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| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-N-[(1-Ethylpyrrolidin-2-yl)methyl]-2-[(2-methoxyphenyl)methylidene]-3-oxo-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170934; BDBM50396523; MLS-0466789.0001
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|
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| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-2-Benzylidene-N-[2-(dipropylamino)ethyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170927; ZINC3064216; BDBM50396504; AKOS001572024; MLS-0466635.0001
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|
||||
| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-2-[(2,6-Difluorophenyl)methylidene]-N-[(1-ethylpyrrolidin-2-yl)methyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170938; BDBM50396519; MLS-0469630.0001
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|
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| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-N-[2-(Azepan-1-yl)ethyl]-2-[(4-methoxyphenyl)methylidene]-3-oxo-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170908; BDBM50396493
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|
||||
| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-N-[2-(Dimethylamino)ethyl]-2-[(2-fluorophenyl)methylidene]-3-oxo-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2171112; BDBM50396512; MLS-0466750.0001
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|
||||
| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-N-[2-(Diethylamino)ethyl]-2-[(3-methylphenyl)methylidene]-3-oxo-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170925; BDBM50396506
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|
||||
| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-2-[(3-Chlorophenyl)methylidene]-N-[2-(dimethylamino)ethyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170920; BDBM50396511
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|
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| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-2-[(2-Chlorophenyl)methylidene]-N-[(1-ethylpyrrolidin-2-yl)methyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170929; BDBM50396488
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|
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| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-2-[(2-Fluorophenyl)methylidene]-3-oxo-N-[(1-propylpyrrolidin-2-yl)methyl]-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170945; BDBM50396515; MLS-0469633.0001
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|
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| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-2-[(3-Methylphenyl)methylidene]-3-oxo-N-(2-pyrrolidin-1-ylethyl)-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170915; BDBM50396499
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|
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| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-N-[2-(Diethylamino)ethyl]-2-[(3,4-dimethoxyphenyl)methylidene]-3-oxo-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170926; BDBM50396505
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|
||||
| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-2-[(2-Fluorophenyl)methylidene]-3-oxo-N-(pyrrolidin-2-ylmethyl)-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2171111; BDBM50396513; MLS-0469634.0001
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|
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| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-N-[(1-Ethylpyrrolidin-2-yl)methyl]-2-[(3-fluorophenyl)methylidene]-3-oxo-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170935; BDBM50396522; MLS-0469622.0001
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|
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| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-2-Benzylidene-N-[(1-ethylpyrrolidin-2-yl)methyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170932; BDBM50396525; MLS-0466771.0001
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|
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| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(Z)-N-((1-Ethylpyrrolidin-2-yl)methyl)-2-(naphthalen-1-ylmethylene)-3-oxo-3,4-dihydro-2H-benzo[b][1,4]thiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170939; MLS003876174; BDBM50396518; SMR002533129; MLS-0466790.0001
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|
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| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(S,Z)-N-((1-Ethylpyrrolidin-2-yl)methyl)-2-(2-fluorobenzylidene)-3-oxo-3,4-dihydro-2H-benzo[b][1,4]thiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170944; MLS003876170; BDBM50396516; SMR002533125; MLS-0466788.0001; MLS-0466788.0002
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|
||||
| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-2-[(2-Fluorophenyl)methylidene]-N-(2-morpholin-4-ylethyl)-3-oxo-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170917; BDBM50396497; MLS-0466751.0001
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|
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| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-N-[(1-Ethylpyrrolidin-2-yl)methyl]-2-[(2-fluorophenyl)methylene]-3-oxo-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2171113; MLS003876171; BDBM50396486; SMR002533126; MLS-0466672.0001; MLS-0466672.0002
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|
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| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-2-[(2-Chlorophenyl)methylidene]-3-oxo-N-(2-pyrrolidin-1-ylethyl)-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170914; BDBM50396500
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|
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| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-N-[(1-Ethylpyrrolidin-2-yl)methyl]-2-[(4-fluorophenyl)methylidene]-3-oxo-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170936; BDBM50396521; MLS-0469623.0001
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|
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| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-N-[2-(Dipropylamino)ethyl]-2-[(4-methylphenyl)methylidene]-3-oxo-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170928; BDBM50396503
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|
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| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-2-Benzylidene-3-oxo-N-(3-pyrrolidin-1-ylpropyl)-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
MLS001030711; SMR000635244; CHEMBL1337166; BDBM70014; cid_24792850; HMS2961G15; REGID_for_CID_24792850; ZINC3063925; AKOS002129410; (2Z)-2-benzal-3-keto-N-(3-pyrrolidinopropyl)-4H-1,4-benzothiazine-6-carboxamide
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|
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| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-2-[(3-Chlorophenyl)methylidene]-3-oxo-N-(3-pyrrolidin-1-ylpropyl)-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170931; BDBM50396484
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|
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| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-N-Benzyl-2-[(2-fluorophenyl)methylidene]-3-oxo-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170911; BDBM50396490; MLS-0466792.0001
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|
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| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-N-[2-(Azepan-1-yl)ethyl]-2-[(2-chlorophenyl)methylidene]-3-oxo-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170919; BDBM50396495
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|
||||
| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-2-[(2-Chlorophenyl)methylidene]-N-[2-(diethylamino)ethyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170924; BDBM50396507
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|
||||
| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
Chembl4165870
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|
Investigative | Compound Info | ||
| Synonyms |
MLS004255458; ML304; BDBM50292581; NCGC00386836-01; SMR003080924; MLS-0471552.0001; MLS-0471552.0002
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|
||||
| Activity |
IC50 ~ 80000 nM
|
[3] | |||
| Compound Name |
Tert-butyl 2-[[[(2Z)-2-[(2-fluorophenyl)methylidene]-3-oxo-4H-1,4-benzothiazine-6-carbonyl]amino]methyl]pyrrolidine-1-carboxylate
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2171110; BDBM50396514; MLS-0469632.0001
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|
||||
| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-N-[2-(Azepan-1-yl)ethyl]-2-[(3-methoxyphenyl)methylidene]-3-oxo-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170907; BDBM50396494
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|
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| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-2-[(2-Fluorophenyl)methylidene]-3-oxo-N-(2-piperidin-1-ylethyl)-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170916; BDBM50396498; MLS-0466787.0001
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|
||||
| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-2-[(4-Methoxyphenyl)methylidene]-3-oxo-N-(2-pyrrolidin-1-ylethyl)-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170913; BDBM50396501; 2-[(Z)-4-Methoxybenzylidene]-6-[[2-pyrrolizinoethyl]carbamoyl]-2H-1,4-benzothiazine-3(4H)-one
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|
||||
| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
(2Z)-N-[(1-Ethylpyrrolidin-2-yl)methyl]-2-(naphthalen-2-ylmethylidene)-3-oxo-4H-1,4-benzothiazine-6-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2170940; BDBM50396517; MLS-0469624.0001
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|
||||
| Activity |
IC50 ~ 80000 nM
|
[2] | |||
| Compound Name |
[(3S,5S,8R,9S,10S,13S,14S,17S)-17-Acetyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl]urea
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2057304; BDBM50388502
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|
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| Activity |
IC50 ~ 100000 nM
|
[1] | |||
| Compound Name |
N-[(3S,5S,8R,9S,10S,13S,14S)-10,13-Dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl]acetamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2057290; BDBM50388519; ZINC34375107
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|
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| Activity |
IC50 = 128000 nM
|
[1] | |||
| Compound Name |
Chembl4167547
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|
Investigative | Compound Info | ||
| Synonyms |
BDBM50292587
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|
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| Activity |
Ki = 129000 nM
|
[3] | |||
| Click to Show/Hide the Information of All Poor Binders | |||||
| Non Binders of This Target (in total, 25 non binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
ANDROSTERONE
Click to Show/Hide
|
Phase 3 | Compound Info | ||
| Synonyms |
androsterone; 53-41-8; Androkinine; Androtine; 5alpha-Androsterone; Atromide ICI; 3alpha-Hydroxy-5alpha-androstan-17-one; 3-Epihydroxyetioallocholan-17-one; cis-Androsterone; 3alpha-Hydroxyetioallocholan-17-one; 5alpha-Androstane-3alpha-ol-17-one; 3alpha-Hydroxy-17-androstanone; Androstanon-3-alpha-ol-17-one; 3-alpha-Hydroxy-17-androstanone; 3-alpha-Hydroxyetioallocholan-17-one; 3-alpha-Hydroxy-5-alpha-androstan-17-one; 5-alpha-Androstan-3-alpha-ol-17-one; Caswell No. 051G; Androstan-17-one, 3-hydroxy-, (3alpha,5alpha)-
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| Activity |
IC50 > 200000 nM
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[1] | |||
| Compound Name |
(3S,5S,8R,9S,10S,13S,14S,17R)-10,13-Dimethylspiro[1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-17,2'-oxetane]-3-ol
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2057643; BDBM50388514
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| Activity |
IC50 > 200000 nM
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[1] | |||
| Compound Name |
N-[(3S,5S,8R,9S,10S,13S,14S,17S)-17-Acetyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl]acetamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2057303; BDBM50388525
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| Activity |
IC50 > 200000 nM
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[1] | |||
| Compound Name |
N-[(3R,5S,8R,9S,10S,13S,14S)-10,13-Dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl]methanesulfonamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2057314; BDBM50388509
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| Activity |
IC50 > 200000 nM
|
[1] | |||
| Compound Name |
3-[(3S,5S,8R,9S,10S,13S,14S)-10,13-Dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl]-1,1-dimethylurea
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2057295; BDBM50388497
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| Activity |
IC50 > 200000 nM
|
[1] | |||
| Compound Name |
(3S,8R,9S,10R,13S,14S,17R)-10,13-Dimethylspiro[1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-17,2'-oxetane]-3-ol
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2057970; BDBM50388476; ZINC84672466
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| Activity |
IC50 > 200000 nM
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[1] | |||
| Compound Name |
(3R,5S,8R,9S,10S,13S,14S)-3-Amino-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-one;hydrochloride
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2057312; SCHEMBL2548847
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| Activity |
IC50 > 200000 nM
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[1] | |||
| Compound Name |
3beta-Amino-5alpha-pregnane-20-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2057302; SCHEMBL20167195; BDBM50388501; ZINC71769682; (3beta,5alpha)-3-aminopregnan-20-one
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| Activity |
IC50 > 200000 nM
|
[1] | |||
| Compound Name |
(3S,8R,9S,10R,13S,14S,17S)-10,13-Dimethylspiro[1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-17,2'-oxirane]-3-ol
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1076355; SCHEMBL3087932; BDBM50388475; ZINC49034785
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| Activity |
IC50 > 200000 nM
|
[1] | |||
| Compound Name |
17beta-(2-Oxopropyl)-5alpha-androstane-3beta-ol
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2057641; BDBM50388496
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| Activity |
IC50 > 200000 nM
|
[1] | |||
| Compound Name |
Chembl4169301
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Investigative | Compound Info | ||
| Synonyms |
BDBM50292586
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| Activity |
Ki > 200000 nM
|
[3] | |||
| Compound Name |
3beta-Amino-5alpha-androstane-17-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2057289; SCHEMBL20166974; BDBM50388518; ZINC34548922
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| Activity |
IC50 > 200000 nM
|
[1] | |||
| Compound Name |
3-[(3S,5S,8R,9S,10S,13S,14S,17S)-17-Acetyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl]-1,1-dimethylurea
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2057305; BDBM50388503
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| Activity |
IC50 > 200000 nM
|
[1] | |||
| Compound Name |
5alpha-Androstan-17-one
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Investigative | Compound Info | ||
| Synonyms |
5.alpha.-Androstan-17-one; 17-Oxo-5.alpha.-androstane; Androstan-17-one, (5a)-; CHEMBL2057976; Androstan-17-one, (5.alpha.)-; Androstan-17-one #; 5a-androstan-17-one; 17-Oxo-5alpha-androstane; NSC90582; EINECS 213-516-8; NSC 90582; 5-alpha-Androstan-17-one; SCHEMBL1908291; CTK3I7348; TQP0567; ZINC3881387; 6522AF; BDBM50388481; NSC-90582; Androstan-17-one, (5alpha)- (9CI); (5R,8R,10S,13S)-10,13-Dimethyl-hexadecahydro-cyclopenta[a]phenanthren-17-one
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| Activity |
IC50 > 200000 nM
|
[1] | |||
| Compound Name |
(3R,5S,8R,9S,10S,13S,14S)-10,13-Dimethyl-17-oxo-3-(sulfamoylamino)-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2057315; SCHEMBL20167081; BDBM50388510
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| Activity |
IC50 > 200000 nM
|
[1] | |||
| Compound Name |
3beta-Hydroxy-16alpha,17alpha-epoxy-5alpha-pregnan-20-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1308588; MLS001163981; HMS2875A22; ZINC3982455; BDBM50388485; AKOS030504165; MCULE-7976282909; NCGC00246182-01; SMR000539332
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| Activity |
IC50 > 200000 nM
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[1] | |||
| Compound Name |
Chembl4159624
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Investigative | Compound Info | ||
| Synonyms |
BDBM50292589
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| Activity |
Ki > 200000 nM
|
[3] | |||
| Compound Name |
1-[(3R,5S,8R,9S,10S,13S,14S)-10,13-Dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl]-3-ethylurea
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2057313; BDBM50388526
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| Activity |
IC50 > 200000 nM
|
[1] | |||
| Compound Name |
1-[(3S,5S,8R,9S,10S,13S,14S,17R)-3-Hydroxy-17-methoxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-yl]ethanone
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2057644; BDBM50388527
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| Activity |
IC50 > 200000 nM
|
[1] | |||
| Compound Name |
Chembl4162165
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Investigative | Compound Info | ||
| Synonyms |
BDBM50292590
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| Activity |
Ki > 200000 nM
|
[3] | |||
| Compound Name |
Methyl N-[(3S,5S,8R,9S,10S,13S,14S,17S)-17-acetyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl]carbamate
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2057306; BDBM50388504
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||||
| Activity |
IC50 > 200000 nM
|
[1] | |||
| Compound Name |
(3S,5S,8R,9S,10S,13S,14S,17S)-10,13-Dimethylspiro[1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-17,2'-oxirane]-3-ol
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2057642; BDBM50388513; ZINC84712324
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| Activity |
IC50 > 200000 nM
|
[1] | |||
| Compound Name |
CID 70084189
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2057972; SCHEMBL7414868; BDBM50388524; ZINC38411499
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| Activity |
IC50 > 200000 nM
|
[1] | |||
| Compound Name |
Chembl4164794
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Investigative | Compound Info | ||
| Synonyms |
BDBM50292583
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| Activity |
Ki > 400000 nM
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[3] | |||
| Compound Name |
Chembl4172838
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Investigative | Compound Info | ||
| Synonyms |
BDBM50292580
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| Activity |
Ki > 2000000 nM
|
[3] | |||
| Click to Show/Hide the Information of All Non Binders | |||||
| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Novel steroid inhibitors of glucose 6-phosphate dehydrogenase. J Med Chem. 2012 May 10;55(9):4431-45. | ||||
| REF 2 | Discovery of a Plasmodium falciparum glucose-6-phosphate dehydrogenase 6-phosphogluconolactonase inhibitor (R,Z)-N-((1-ethylpyrrolidin-2-yl)methyl)-2-(2-fluorobenzylidene)-3-oxo-3,4-dihydro-2H-benzo[b][1,4]thiazine-6-carboxamide (ML276) that reduces parasite growth in vitro. J Med Chem. 2012 Aug 23;55(16):7262-72. | ||||
| REF 3 | First homology model of Plasmodium falciparum glucose-6-phosphate dehydrogenase: Discovery of selective substrate analog-based inhibitors as novel antimalarial agents. Eur J Med Chem. 2018 Feb 25;146:108-122. | ||||
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