Target
Adenosine deaminase
Ligand
BDBM50288073
Substrate
n/a
Meas. Tech.
ChEMBL_30800 (CHEMBL645076)
Ki
50.7±n/a nM
Citation
 Pragnacharyulu, PVVarkhedkar, VCurtis, MAChang, IFAbushanab, 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:
BDBM50288073
Synonyms:
(E)-(2S,3R)-3-(6-Amino-purin-9-yl)-non-5-en-2-ol | 3-(6-Amino-purin-9-yl)-non-5-en-2-ol | CHEMBL81378
Type:
Small organic molecule
Emp. Form.:
C14H21N5O
Mol. Mass.:
275.3494
SMILES:
CCC\C=C\C[C@H]([C@H](C)O)n1cnc2c(N)ncnc12
Structure:
Search PDB for entries with ligand similarity: