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Target
Adenosine deaminase
Ligand
BDBM22917
Substrate
n/a
Meas. Tech.
ChEMBL_458972 (CHEMBL925066)
Ki
5900000±n/a nM
Citation
 Dessalew, N; Bharatam, PV Structure based de novo design of novel glycogen synthase kinase 3 inhibitors. Bioorg Med Chem 15:3728-36 (2007) [PubMed]  Article
Target
Name:
Adenosine deaminase
Synonyms:
ADA | ADA1 | ADA_HUMAN | Adenosine aminohydrolase
Type:
Enzyme
Mol. Mass.:
40759.44
Organism:
Homo sapiens (Human)
Description:
Human recombinant ADA was expressed and purified from an ADA-deficient bacterial strain.
Residue:
363
Sequence:
MAQTPAFDKPKVELHVHLDGSIKPETILYYGRRRGIALPANTAEGLLNVIGMDKPLTLPDFLAKFDYYMPAIAGCREAIKRIAYEFVEMKAKEGVVYVEVRYSPHLLANSKVEPIPWNQAEGDLTPDEVVALVGQGLQEGERDFGVKARSILCCMRHQPNWSPKVVELCKKYQQQTVVAIDLAGDETIPGSSLLPGHVQAYQEAVKSGIHRTVHAGEVGSAEVVKEAVDILKTERLGHGYHTLEDQALYNRLRQENMHFEICPWSSYLTGAWKPDTEHAVIRLKNDQANYSLNTDDPLIFKSTLDTDYQMTKRDMGFTEEEFKRLNINAAKSSFLPEDEKRELLDLLYKAYGMPPSASAGQNL
  
Inhibitor
Name:
BDBM22917
Synonyms:
1-(1-hydroxy-4-phenylbutan-2-yl)-1H-imidazole-4-carboxamide | CHEMBL13696 | FR221647 | imidazole-4-carboxamide derivative, 1
Type:
Small organic molecule
Emp. Form.:
C14H17N3O2
Mol. Mass.:
259.3037
SMILES:
NC(=O)c1cn(cn1)C(CO)CCc1ccccc1
Structure:
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