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Target
Adenosine deaminase
Ligand
BDBM50070646
Substrate
n/a
Meas. Tech.
ChEMBL_30800 (CHEMBL645076)
Ki
0.76±n/a nM
Citation
 Pragnacharyulu, PV; Varkhedkar, V; Curtis, MA; Chang, IF; Abushanab, E Adenosine deaminase inhibitors: synthesis and biological evaluation of unsaturated, aromatic, and oxo derivatives of (+)-erythro-9-(2'S-hydroxy-3'R-nonyl)adenine [(+)-EHNA]. J Med Chem 43:4694-700 (2001) [PubMed]  Article 
Target
Name:
Adenosine deaminase
Synonyms:
ADA | ADA_BOVIN | Adenosine aminohydrolase
Type:
Enzyme
Mol. Mass.:
40910.44
Organism:
Bos taurus (bovine)
Description:
n/a
Residue:
363
Sequence:
MAQTPAFNKPKVELHVHLDGAIKPETILYYGRKRGIALPADTPEELQNIIGMDKPLSLPEFLAKFDYYMPAIAGCREAVKRIAYEFVEMKAKDGVVYVEVRYSPHLLANSKVEPIPWNQAEGDLTPDEVVSLVNQGLQEGERDFGVKVRSILCCMRHQPSWSSEVVELCKKYREQTVVAIDLAGDETIEGSSLFPGHVKAYAEAVKSGVHRTVHAGEVGSANVVKEAVDTLKTERLGHGYHTLEDATLYNRLRQENMHFEVCPWSSYLTGAWKPDTEHPVVRFKNDQVNYSLNTDDPLIFKSTLDTDYQMTKNEMGFTEEEFKRLNINAAKSSFLPEDEKKELLDLLYKAYGMPSPASAEQCL
  
Inhibitor
Name:
BDBM50070646
Synonyms:
(2S,3R)-3-(6-Amino-purin-9-yl)-7-phenyl-heptan-2-ol | 3-(6-Amino-purin-9-yl)-7-phenyl-heptan-2-ol | CHEMBL295003
Type:
Small organic molecule
Emp. Form.:
C18H23N5O
Mol. Mass.:
325.4081
SMILES:
C[C@H](O)[C@@H](CCCCc1ccccc1)n1cnc2c(N)ncnc12
Structure:
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