Molecule Details
InChIKeyJHBXNPBKSPYOFT-UHFFFAOYSA-N
Compound Name9-(4-Hydroxybutyl)-N2-Phenylguanine
Canonical SMILESO=c1[nH]c(Nc2ccccc2)nc2c1ncn2CCCCO
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)2
Pfam Stratification Cross-Family
Avg pChEMBL7.05
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
DrugBank Annotations
DrugBank ID DB02495
Drug Name9-(4-hydroxybutyl)-N2-phenylguanine
CAS Numbernan
Groups experimental
ATC Codes nan
Description9-(4-hydroxybutyl)-N2-phenylguanine is a solid. This compound belongs to the hypoxanthines. These are compounds containing the purine derivative 1H-purin-6(9H)-one. 9-(4-hydroxybutyl)-n2-phenylguanine is known to target thymidine kinase.

Cross-references: BindingDB: 21866 CHEMBL406254 ChemSpider: 395019 PDB: BPG PubChem:448110 PubChem:46507186
Target Activities (2)
Target Gene Organism Category Pfam pChEMBL Type Source
P04183 TK1 Homo sapiens Human PF00265 7.3 Ki ChEMBL;BindingDB
Q9QNF7 TK Human herpesvirus 1 Pathogen PF00693 6.8 IC50 ChEMBL;BindingDB
DrugBank Target Actions (2)
Target Gene Target Name Action Type
P04183 TK1 Thymidine kinase, cytosolic inhibitor targets
Q9QNF7 TK Thymidine kinase inhibitor targets