BDBM50348875 CHEMBL1807154

SMILES: OC[C@H]1O[C@@H](n2cc(Br)c(=O)[nH]c2=O)C(F)(F)[C@@H]1O

InChI Key: InChIKey=ZBQKEEPEYPQFAF-WYDQCIBASA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50348875   

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 (Human herpesvirus 1)	BDBM50348875 (CHEMBL1807154) Show SMILES OC[C@H]1O[C@@H](n2cc(Br)c(=O)[nH]c2=O)C(F)(F)[C@@H]1O |r| Show InChI InChI=1S/C9H9BrF2N2O5/c10-3-1-14(8(18)13-6(3)17)7-9(11,12)5(16)4(2-15)19-7/h1,4-5,7,15-16H,2H2,(H,13,17,18)/t4-,5-,7-/m1/s1	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Cardiff University Curated by ChEMBL					Assay Description Inhibition of Herpes simplex virus-1 thymidine kinase-mediated phosphorylation of [methyl-3H]dThd at 1 uM after 30 mins by scintillation counting				Bioorg Med Chem 19: 4338-45 (2011) Article DOI: 10.1016/j.bmc.2011.05.037 BindingDB Entry DOI: 10.7270/Q25B02T6
					More data for this Ligand-Target Pair
Thymidine kinase (Feline herpesvirus 1)	BDBM50348875 (CHEMBL1807154) Show SMILES OC[C@H]1O[C@@H](n2cc(Br)c(=O)[nH]c2=O)C(F)(F)[C@@H]1O |r| Show InChI InChI=1S/C9H9BrF2N2O5/c10-3-1-14(8(18)13-6(3)17)7-9(11,12)5(16)4(2-15)19-7/h1,4-5,7,15-16H,2H2,(H,13,17,18)/t4-,5-,7-/m1/s1	KEGG UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
Cardiff University Curated by ChEMBL					Assay Description Inhibition of Feline herpesvirus thymidine kinase assessed as phosphorylation of 1 uM [methyl-3H]dThd after 30 mins by scintillation counting				Bioorg Med Chem 19: 4338-45 (2011) Article DOI: 10.1016/j.bmc.2011.05.037 BindingDB Entry DOI: 10.7270/Q25B02T6
					More data for this Ligand-Target Pair