Reaction Details Report a problem with these data
Target
Purine nucleoside phosphorylase
Ligand
BDBM50214705
Substrate
n/a
Meas. Tech.
ChEMBL_162194 (CHEMBL766713)
Ki
18±n/a nM
Citation
 Halazy, S; Eggenspiller, A; Ehrhard, A; Danzin, C Phosphonate derivatives of N9-benzylguanine: a new class of potent purine nucleoside phosphorylase inhibitors Bioorg Med Chem Lett 2:407-410 (1992)    Article 
Target
Name:
Purine nucleoside phosphorylase
Synonyms:
Inosine phosphorylase | Inosine-guanosine phosphorylase | NP | PNP | PNPH_HUMAN | Purine nucleoside phosphorylase (PNPase)
Type:
Enzyme
Mol. Mass.:
32119.53
Organism:
Homo sapiens (Human)
Description:
n/a
Residue:
289
Sequence:
MENGYTYEDYKNTAEWLLSHTKHRPQVAIICGSGLGGLTDKLTQAQIFDYGEIPNFPRSTVPGHAGRLVFGFLNGRACVMMQGRFHMYEGYPLWKVTFPVRVFHLLGVDTLVVTNAAGGLNPKFEVGDIMLIRDHINLPGFSGQNPLRGPNDERFGDRFPAMSDAYDRTMRQRALSTWKQMGEQRELQEGTYVMVAGPSFETVAECRVLQKLGADAVGMSTVPEVIVARHCGLRVFGFSLITNKVIMDYESLEKANHEEVLAAGKQAAQKLEQFVSILMASIPLPDKAS
  
Inhibitor
Name:
BDBM50214705
Synonyms:
5-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-1,1-difluoropentylphosphonate | 9-(5',5'-difluoro-5'-phosphonopentyl)guanine | 9-(5,5-DIFLUORO-5-PHOSPHONOPENTYL)GUANINE | CHEMBL236708 | [5-(2-Amino-6-oxo-1,6-dihydro-purin-9-yl)-1,1-difluoro-pentyl]-phosphonic acid
Type:
Small organic molecule
Emp. Form.:
C10H14F2N5O4P
Mol. Mass.:
337.2198
SMILES:
Nc1nc2n(CCCCC(F)(F)P(O)(O)=O)cnc2c(=O)[nH]1
Structure:
Search PDB for entries with ligand similarity: