Reaction Details Report a problem with these data
Target
GTP:AMP phosphotransferase AK3, mitochondrial
Ligand
BDBM50367092
Substrate
n/a
Meas. Tech.
ChEMBL_32200 (CHEMBL648979)
Ki
4800000±n/a nM
Citation
 Hampton, A; Kappler, F; Picker, D Species- or isozyme-specific enzyme inhibitors. 4. Design of a two-site inhibitor of adenylate kinase with isozyme selectivity. J Med Chem 25:638-44 (1982) [PubMed]  Article 
Target
Name:
GTP:AMP phosphotransferase AK3, mitochondrial
Synonyms:
AK 3 | Adenylate kinase 3 | Adenylate kinase 3 alpha like 1 | Adenylate kinase 3 alpha-like 1 | Ak3 | Ak3l1 | Akl3l | GTP:AMP phosphotransferase mitochondrial | KAD3_RAT
Type:
PROTEIN
Mol. Mass.:
25443.58
Organism:
Rattus norvegicus
Description:
ChEMBL_1340551
Residue:
227
Sequence:
MGASGRLLRAVIMGAPGSGKGTGSSRITKHFELKHLSSGDLLRQNMLQGTEIAVLAKSFIDQGKLIPDDDMTRLALHELKNLTQCSWLLDGFPRTLPQAEALDRVYQIDTVINLNVPFEVIKLRLTARWIHPASGRVYNIEFNPPKTVGIDDLTGEPLIQREDDKPETVIKRLKAYEAQTEPVLQYYQKKGVLETFSGTETNKIRPHVYSFLQMKVPETIQKASVTP
  
Inhibitor
Name:
BDBM50367092
Synonyms:
CHEMBL1744387
Type:
Small organic molecule
Emp. Form.:
C18H30N6O14P3
Mol. Mass.:
647.3844
SMILES:
CC(=O)NCCCCCCNc1ncnc2n(cnc12)C1O[C@H](COP(O)(=O)OP(O)(=O)OP(O)([O-])=O)[C@@H](O)[C@H]1O |r|
Structure:
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