BDBM50217798 3-(2-deoxy-beta-D-erythro-pentofuranosyl)-6-[2-(pent-1-yn-1-yl)-pyrid-5-yl]furo[2,3-d]pyrimidin-2(3H)-one::CHEMBL397671
SMILES: CCCC#Cc1ccc(cn1)-c1cc2cn([C@H]3C[C@H](O)[C@@H](CO)O3)c(=O)nc2o1
InChI Key: InChIKey=OSUWOOMAEHCWGZ-QXAKKESOSA-N
Data: 1 IC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Thymidine kinase (Varicella-zoster virus (strain Dumas) (HHV-3) (Hum...) | BDBM50217798 (3-(2-deoxy-beta-D-erythro-pentofuranosyl)-6-[2-(pe...) | PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 2.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Brigham Young University Curated by ChEMBL | Assay Description Inhibition of VZV thymidine kinase | J Med Chem 50: 3897-905 (2007) Article DOI: 10.1021/jm070210n BindingDB Entry DOI: 10.7270/Q2S75G19 | |||||||||||
More data for this Ligand-Target Pair |