Reaction Details Report a problem with these data
Target
Adenosine deaminase
Ligand
BDBM22948
Substrate
n/a
Meas. Tech.
ChEMBL_2238229 (CHEMBL5152125)
Ki
3.6±n/a nM
Citation
 Hou, R; He, Y; Yan, G; Hou, S; Xie, Z; Liao, C Zinc enzymes in medicinal chemistry. Eur J Med Chem 226:0 (2021) [PubMed] 
Target
Name:
Adenosine deaminase
Synonyms:
ADA_MOUSE | Ada
Type:
PROTEIN
Mol. Mass.:
39984.63
Organism:
Mus musculus
Description:
ChEMBL_31100
Residue:
352
Sequence:
MAQTPAFNKPKVELHVHLDGAIKPETILYFGKKRGIALPADTVEELRNIIGMDKPLSLPGFLAKFDYYMPVIAGCREAIKRIAYEFVEMKAKEGVVYVEVRYSPHLLANSKVDPMPWNQTEGDVTPDDVVDLVNQGLQEGEQAFGIKVRSILCCMRHQPSWSLEVLELCKKYNQKTVVAMDLAGDETIEGSSLFPGHVEAYEGAVKNGIHRTVHAGEVGSPEVVREAVDILKTERVGHGYHTIEDEALYNRLLKENMHFEVCPWSSYLTGAWDPKTTHAVVRFKNDKANYSLNTDDPLIFKSTLDTDYQMTKKDMGFTEEEFKRLNINAAKSSFLPEEEKKELLERLYREYQ
  
Inhibitor
Name:
BDBM22948
Synonyms:
1-[(1R,2S)-2-hydroxy-1-(2-naphthalen-1-ylethyl)propyl]-1H-imidazole-4-carboxamide | 1-[(3R,4S)-4-hydroxy-1-(naphthalen-1-yl)pentan-3-yl]-1H-imidazole-4-carboxamide | CHEMBL93560 | imidazole-4-carboxamide analogue, 5
Type:
Small organic molecule
Emp. Form.:
C19H21N3O2
Mol. Mass.:
323.3889
SMILES:
C[C@H](O)[C@@H](CCc1cccc2ccccc12)n1cnc(c1)C(N)=O |r|
Structure:
Search PDB for entries with ligand similarity: