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Literature summary for 3.5.4.4 extracted from

  • Kandalkar, S.R.; Ramaiah, P.A.; Joshi, M.; Wavhal, A.; Waman, Y.; Raje, A.A.; Tambe, A.; Ansari, S.; De, S.; Palle, V.P.; Mookhtiar, K.A.; Deshpande, A.M.; Barawkar, D.A.
    Modifications of flexible nonyl chain and nucleobase head group of (+)-erythro-9-(2s-hydroxy-3s-nonyl)adenine [(+)-EHNA] as adenosine deaminase inhibitors (2017), Bioorg. Med. Chem., 25, 5799-5819 .
    View publication on PubMed
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Inhibitors

Inhibitors Comment Organism Structure
(+)-erythro-9-(2-hydroxy-3-nonyl)adenine
-
 Bos taurus
(2S,3R)-3-(6-amino-9H-purin-9-yl)-5-[3-(trifluoromethyl)phenyl]pentan-2-ol comopound shows suitable balance of potency, microsomal stability and demonstrates better pharmacokinetic properties as compared to (+)-erythro-9-(2-hydroxy-3-nonyl)adenine Bos taurus
(2S,3R)-3-(6-amino-9H-purin-9-yl)-5-[4-(trifluoromethyl)phenyl]pentan-2-ol comopound shows suitable balance of potency, microsomal stability and demonstrates better pharmacokinetic properties as compared to (+)-erythro-9-(2-hydroxy-3-nonyl)adenine Bos taurus
1-[(3R,4S)-4-hydroxy-1-[3-(trifluoromethyl)phenyl]pentan-3-yl]-1H-imidazole-4-carboxamide comopound shows suitable balance of potency, microsomal stability and demonstrates better pharmacokinetic properties as compared to (+)-erythro-9-(2-hydroxy-3-nonyl)adenine Bos taurus

Organism

Organism UniProt Comment Textmining
Bos taurus P56658
-
-

Ki Value [mM]

Ki Value [mM] Ki Value maximum [mM] Inhibitor Comment Organism Structure
0.00000011
-
 (2S,3R)-3-(6-amino-9H-purin-9-yl)-5-[3-(trifluoromethyl)phenyl]pentan-2-ol pH 7.0, temperature not specified in the publication Bos taurus
0.0000022
-
 (+)-erythro-9-(2-hydroxy-3-nonyl)adenine pH 7.0, temperature not specified in the publication Bos taurus
0.0000052
-
 (2S,3R)-3-(6-amino-9H-purin-9-yl)-5-[4-(trifluoromethyl)phenyl]pentan-2-ol pH 7.0, temperature not specified in the publication Bos taurus
0.0000059
-
 1-[(3R,4S)-4-hydroxy-1-[3-(trifluoromethyl)phenyl]pentan-3-yl]-1H-imidazole-4-carboxamide pH 7.0, temperature not specified in the publication Bos taurus