Target Poor or Non Binder(s) Information
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T65501 | Target Info | |||
| Target Name | DNA [cytosine-5]-methyltransferase 3B (DNMT3B) | ||||
| Synonyms |
M.HsaIIIB; Dnmt3b; DNA methyltransferase HsaIIIB; DNA methyltransferase 3B; DNA MTase HsaIIIB; DNA (cytosine-5)-methyltransferase 3B
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| Target Type | Clinical trial Target | ||||
| Gene Name | DNMT3B | ||||
| Biochemical Class | Methyltransferase | ||||
| UniProt ID | |||||
| Poor Binders of This Target (in total, 7 binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
1-(2-((((2S,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl)thio)ethyl)-3-ethylurea
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Investigative | Compound Info | ||
| Synonyms |
DS-437; CHEMBL3577854; EX-A3697; BDBM50089221; HY-124131; CS-0084441
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| Activity |
IC50 ~ 50000 nM
|
[1] | |||
| Compound Name |
(2S,4R)-4-(((2S,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methylthio)pyrrolidine-2-carboxylic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL563230; BDBM50294558
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| Activity |
IC50 = 54000 nM
|
[2] | |||
| Compound Name |
2-Amino-4-(((2S,3S,4R,5R)-5-(6-amino-2-chloro-9H-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl)methylthio)butanoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL564768; SCHEMBL5052442; BDBM50294486
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| Activity |
IC50 = 57200 nM
|
[3] | |||
| Compound Name |
(2R,3R,4S,5S)-2-(6-Amino-9H-purin-9-yl)-5-(((1R,2S)-2-aminocyclopentylthio)methyl)tetrahydrofuran-3,4-diol
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL559281; BDBM50294570
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| Activity |
IC50 = 66000 nM
|
[2] | |||
| Compound Name |
(2R,3R,4S,5S)-2-(6-Amino-9H-purin-9-yl)-5-(((S)-pyrrolidin-2-ylmethylthio)methyl)tetrahydrofuran-3,4-diol
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL563782; BDBM50294568
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| Activity |
IC50 = 100000 nM
|
[2] | |||
| Compound Name |
(2R,3R,4S,5S)-2-(6-Amino-9H-purin-9-yl)-5-((azetidin-3-ylthio)methyl)tetrahydrofuran-3,4-diol
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL539449; BDBM50294571
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| Activity |
IC50 ~ 100000 nM
|
[2] | |||
| Compound Name |
(2R,4S)-4-(((2S,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methylthio)piperidine-2-carboxylic acid
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL563888; BDBM50294561
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|
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| Activity |
IC50 ~ 100000 nM
|
[2] | |||
| Click to Show/Hide the Information of All Poor Binders | |||||
| Non Binders of This Target (in total, 4 non binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
1-((2-(1H-Indol-3-yl)ethyl)amino)-3-(9H-carbazol-9-yl)-propan-2-ol
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Investigative | Compound Info | ||
| Synonyms |
DC_05; DC-05; CHEMBL3358015; C25H25N3O; AOB6967; SYN5082; BDBM50031317; AKOS002242638; AKOS016316322; NCGC00402253-02; AS-16448; DC_05, >=98% (HPLC); HY-12746; ST50753266; 1-carbazol-9-yl-3-[(2-indol-3-ylethyl)amino]propan-2-ol; 1-carbazol-9-yl-3-[2-(1H-indol-3-yl)ethylamino]propan-2-ol; 1-(9H-Carbazole-9-yl)-3-[[2-(1H-indole-3-yl)ethyl]amino]-2-propanol
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| Activity |
IC50 > 200000 nM
|
[4] | |||
| Compound Name |
2-Amino-4-(((2S,3S,4R,5R)-5-(6-amino-2-iodo-9H-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl)methylthio)butanoic acid
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL558882; SCHEMBL5056803; BDBM50294487
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|
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| Activity |
IC50 = 256000 nM
|
[3] | |||
| Compound Name |
2-Amino-4-(((2S,3S,4R,5R)-5-(6-amino-2-(methylthio)-9H-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl)methylthio)butanoic acid
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL558406; BDBM50294490
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|
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| Activity |
IC50 = 500000 nM
|
[3] | |||
| Compound Name |
S-Inosyl-L-homocysteine
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Investigative | Compound Info | ||
| Synonyms |
S-inosinylhomocysteine; CHEMBL559715; S-(5'-deoxyinosin-5'-yl)-L-homocysteine; SCHEMBL3515045; BDBM50294480; C03431; Q27102172
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| Activity |
IC50 > 1000000 nM
|
[3] | |||
| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Discovery of a Dual PRMT5-PRMT7 Inhibitor. ACS Med Chem Lett. 2015 Mar 2;6(4):408-12. | ||||
| REF 2 | Constrained (l-)-S-adenosyl-l-homocysteine (SAH) analogues as DNA methyltransferase inhibitors. Bioorg Med Chem Lett. 2009 May 15;19(10):2742-6. | ||||
| REF 3 | SAR around (l)-S-adenosyl-l-homocysteine, an inhibitor of human DNA methyltransferase (DNMT) enzymes. Bioorg Med Chem Lett. 2009 May 15;19(10):2747-51. | ||||
| REF 4 | Identifying novel selective non-nucleoside DNA methyltransferase 1 inhibitors through docking-based virtual screening. J Med Chem. 2014 Nov 13;57(21):9028-41. | ||||
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