BDBM50293083 7-({[(2R/S)-2,4-Dihydroxybutyl](methyl)amino}methyl)-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one::CHEMBL453099
SMILES: CN(CC(O)CCO)Cc1c[nH]c2c1nc[nH]c2=O
InChI Key: InChIKey=XOFNJPVVVPIKSR-UHFFFAOYSA-N
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Purine nucleoside phosphorylase (Homo sapiens (Human)) | BDBM50293083 (7-({[(2R/S)-2,4-Dihydroxybutyl](methyl)amino}methy...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 2.27E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Industrial Research Limited Curated by ChEMBL | Assay Description Inhibition of human PNP by xanthine-oxidase coupled assay | J Med Chem 52: 1126-43 (2009) Article DOI: 10.1021/jm801421q BindingDB Entry DOI: 10.7270/Q2QR4Z18 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Purine nucleoside phosphorylase (Homo sapiens (Human)) | BDBM50293083 (7-({[(2R/S)-2,4-Dihydroxybutyl](methyl)amino}methy...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | US Patent | n/a | n/a | n/a | 227 | n/a | n/a | n/a | n/a | 25 |
Industrial Research Limited; Albert Einstein College of Medicine of Yeshiva University US Patent | Assay Description The inhibitor dissociation constants reported in Table 1 below are for phosphorolysis of inosine by PNP and were based on reaction rates measurements... | US Patent US8853224 (2014) BindingDB Entry DOI: 10.7270/Q27H1H84 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Purine Nucleoside Phosphorylase (PNP) (Plasmodium falciparum) | BDBM50293083 (7-({[(2R/S)-2,4-Dihydroxybutyl](methyl)amino}methy...) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | US Patent | n/a | n/a | n/a | 770 | n/a | n/a | n/a | n/a | 25 |
Industrial Research Limited; Albert Einstein College of Medicine of Yeshiva University US Patent | Assay Description The inhibitor dissociation constants reported in Table 1 below are for phosphorolysis of inosine by PNP and were based on reaction rates measurements... | US Patent US8853224 (2014) BindingDB Entry DOI: 10.7270/Q27H1H84 | |||||||||||
More data for this Ligand-Target Pair |