Reaction Details Report a problem with these data
Target
Purine nucleoside phosphorylase
Ligand
BDBM50039559
Substrate
n/a
Meas. Tech.
ChEMBL_162035 (CHEMBL766675)
Ki
170±n/a nM
Citation
 Niwas, S; Chand, P; Pathak, VP; Montgomery, JA Structure-based design of inhibitors of purine nucleoside phosphorylase. 5. 9-Deazahypoxanthines. J Med Chem 37:2477-80 (1994) [PubMed]  Article 
Target
Name:
Purine nucleoside phosphorylase
Synonyms:
Inosine phosphorylase | Np | PNPH_RAT | Pnp | Purine nucleoside phosphorylase | Purine-nucleoside phosphorylase | nucleoside phosphorylase
Type:
PROTEIN
Mol. Mass.:
32303.61
Organism:
Rattus norvegicus
Description:
ChEMBL_162034
Residue:
289
Sequence:
MENEFTYEDYQRTAEWLRSHTKHRPQVAVICGSGLGGLTAKLTQPQAFDYNEIPNFPQSTVQGHAGRLVFGFLNGRSCVMMQGRFHMYEGYSLSKVTFPVRVFHLLGVDTLVVTNAAGGLNPKFEVGDIMLIRDHINLPGFCGQNPLRGPNDERFGVRFPAMSDAYDRDMRQKAFNAWKQMGEQRELQEGTYIMSAGPTFETVAESCLLRMLGADAVGMSTVPEVIVARHCGLRVFGFSLITNKVVMDYNNLEKASHQEVLEAGKAAAQKLEQFVSILMESIPPRERAN
  
Inhibitor
Name:
BDBM50039559
Synonyms:
CHEMBL267803 | [5-(2-Amino-6-oxo-1,6-dihydro-purin-9-yl)-pentyl]-phosphonic acid
Type:
Small organic molecule
Emp. Form.:
C10H16N5O4P
Mol. Mass.:
301.2389
SMILES:
Nc1nc2n(CCCCCP(O)(O)=O)cnc2c(=O)[nH]1
Structure:
Search PDB for entries with ligand similarity: