Target Poor or Non Binder(s) Information
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T03661 | Target Info | |||
| Target Name | Adenosine deaminase (ADA) | ||||
| Synonyms |
Adenosine aminohydrolase; ADA1
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| Target Type | Successful Target | ||||
| Gene Name | ADA | ||||
| Biochemical Class | Carbon-nitrogen hydrolase | ||||
| UniProt ID | |||||
| Poor Binders of This Target (in total, 7 binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
1-[alpha-(Hydroxymethyl)benzyl]-1H-imidazole-4-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL14106; SCHEMBL7452471; BDBM22921; imidazole-4-carboxamide compound, 3; 1-(2-hydroxy-1-phenylethyl)imidazole-4-carboxamide; 1-(2-hydroxy-1-phenylethyl)-1H-imidazole-4-carboxamide
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| Activity |
Ki = 54000 nM
|
[1] | |||
| Compound Name |
[5-(6-Amino-purin-9-yl)-oxazolidin-2-yl]-methanol
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL96772; BDBM50007213
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| Activity |
Ki = 85000 nM
|
[2] | |||
| Compound Name |
1-[alpha-(Hydroxymethyl)benzyl]-1H-imidazole-4-methanol
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL274814; BDBM22924; imidazol phenylethanol compound, 6; 2-[4-(hydroxymethyl)-1H-imidazol-1-yl]-2-phenylethanol; 2-[4-(hydroxymethyl)-1H-imidazol-1-yl]-2-phenylethan-1-ol
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| Activity |
Ki ~ 100000 nM
|
[1] | |||
| Compound Name |
Methyl 1-(2-hydroxy-1-phenylethyl)-1H-imidazole-4-carboxylate
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL13697; BDBM22923; imidazole-4-carboxylate compound, 5; 1-[alpha-(Hydroxymethyl)benzyl]-1H-imidazole-4-carboxylic acid methyl ester
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| Activity |
Ki ~ 100000 nM
|
[1] | |||
| Compound Name |
5-(4-Amino-7-ethyl-5-fluoro-1-isobutyl-1H-benzo[d]imidazol-2-yl)furan-2-ylphosphonic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL570790; SCHEMBL4129250; BDBM50303854; [5-[4-amino-7-ethyl-5-fluoro-1-(2-methylpropyl)benzimidazol-2-yl]furan-2-yl]phosphonic acid
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| Activity |
IC50 ~ 100000 nM
|
[3] | |||
| Compound Name |
1-[alpha-(Hydroxymethyl)benzyl]-1H-imidazole-4-carboxylic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL274888; BDBM22922; imidazole-4-carboxylic acid compound, 4; 1-(2-hydroxy-1-phenylethyl)-1H-imidazole-4-carboxylic acid
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| Activity |
Ki ~ 100000 nM
|
[1] | |||
| Compound Name |
3-(4-Amino-pyrrolo[2,3-d]pyrimidin-7-yl)-nonan-2-ol
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL18659; BDBM50011566; 4-Amino-7-[1-(1-hydroxyethyl)heptyl]-7H-pyrrolo[2,3-d]pyrimidine
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| Activity |
Ki = 180000 nM
|
[4] | |||
| Click to Show/Hide the Information of All Poor Binders | |||||
| Non Binders of This Target (in total, 2 non binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
Adenosine
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|
Approved | Compound Info | ||
| Synonyms |
Adenosine, homopolymer; Adenine 9-beta-D-arabinofuranoside; Adenine-9-beta-D-ribofuranoside; Beta-D-Ribofuranoside, adenine-9; EA6C60C2-6AFB-4264-A2F0-541373DB950E; (2R,3R,4S,5R)-2-(6-Aminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol; (2R,3R,4S,5R)-2-(6-amino-9H-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol; 4-Aminopyrazolo[3,4-d]pyrimidine ribonucleoside; 6-Amino-9-.beta.-ribofuranosyl-9H-purine; 6-Amino-9-beta-D-ribofuranosyl-9H-purine; 6-Amino-9beta-D-ribofuranosyl-9H-purine; 9-(beta-D-Arabinofuranosyl)adenine; 9-beta-D-Ribofuranosidoadenine; 9-beta-D-Ribofuranosyl-9H-purin-6-amine; 9-beta-D-Ribofuranosyladenine; 9beta-D-Ribofuranosyladenine
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| Activity |
Ki = 2180000 nM
|
[5] | |||
| Compound Name |
(3R,4S,5R)-2-(4-Aminotriazolo[4,5-d]pyridazin-1-yl)-5-(hydroxymethyl)oxolane-3,4-diol
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL610668; BDBM50368778
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| Activity |
Ki = 1410000 nM
|
[5] | |||
| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Structure-based de novo design of non-nucleoside adenosine deaminase inhibitors. Bioorg Med Chem Lett. 2003 Mar 24;13(6):1115-8. | ||||
| REF 2 | Synthesis and biological evaluation of 4-purinylpyrrolidine nucleosides. J Med Chem. 1991 Sep;34(9):2787-97. | ||||
| REF 3 | Fructose-1,6-bisphosphatase Inhibitors. 2. Design, synthesis, and structure-activity relationship of a series of phosphonic acid containing benzimidazoles that function as 5'-adenosinemonophosphate (AMP) mimics. J Med Chem. 2010 Jan 14;53(1):441-51. | ||||
| REF 4 | Adenosine deaminase inhibitors. Synthesis and biological activity of deaza analogues of erythro-9-(2-hydroxy-3-nonyl)adenine. J Med Chem. 1988 Feb;31(2):390-3. | ||||
| REF 5 | Synthesis and biological evaluation of N4-substituted imidazo- and v-triazolo[4,5-d]pyridazine nucleosides. J Med Chem. 1993 Dec 10;36(25):4113-20. | ||||
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