Reaction Details Report a problem with these data
Target
Adenylate kinase isoenzyme 1
Ligand
BDBM50277972
Substrate
n/a
Meas. Tech.
ChEMBL_502057 (CHEMBL981268)
IC50
>500000±n/a nM
Citation
 Dang, Q; Brown, BS; Liu, Y; Rydzewski, RM; Robinson, ED; van Poelje, PD; Reddy, MR; Erion, MD Fructose-1,6-bisphosphatase inhibitors. 1. Purine phosphonic acids as novel AMP mimics. J Med Chem 52:2880-98 (2009) [PubMed]  Article 
Target
Name:
Adenylate kinase isoenzyme 1
Synonyms:
AK1 | KAD1_RABIT
Type:
PROTEIN
Mol. Mass.:
21643.19
Organism:
Oryctolagus cuniculus
Description:
ChEMBL_502057
Residue:
194
Sequence:
MEEKLKKAKIIFVVGGPGSGKGTQCEKIVHKYGYTHLSTGDLLRAEVSSGSARGKKLSEIMEKGQLVPLETVLDMLRDAMVAKADTSKGFLIDGYPRQVQQGEEFERRIAQPTLLLYVDAGPETMQKRLLKRGETSGRVDDNEETIKKRLETYYKATEPVIAFYEKRGIVRKVNAEGSVDNVFSQVCTHLDALK
  
Inhibitor
Name:
BDBM50277972
Synonyms:
CHEMBL519503 | [5-(6-Amino-9-phenethyl-9H-purin-8-yl)-furan-2-yl]-phosphonic Acid
Type:
Small organic molecule
Emp. Form.:
C17H16N5O4P
Mol. Mass.:
385.3138
SMILES:
Nc1ncnc2n(CCc3ccccc3)c(nc12)-c1ccc(o1)P(O)(O)=O
Structure:
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