Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Thymidine kinase, cytosolic' and Ligand = 'BDBM50027352'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Thymidine kinase, cytosolic (Homo sapiens (Human))	BDBM50027352 (1-(4,5-Dihydroxy-tetrahydro-furan-2-yl)-5-methylsu...) Show SMILES CSc1cnc(=O)n(c1)C1CC(O)C(O)O1 Show InChI InChI=1S/C9H12N2O4S/c1-16-5-3-10-9(14)11(4-5)7-2-6(12)8(13)15-7/h3-4,6-8,12-13H,2H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for the binding affinity to thymidine kinase from HSV-1 infected HeLa Bu				J Med Chem 24: 109-12 (1981) BindingDB Entry DOI: 10.7270/Q2DF6Q7X
					More data for this Ligand-Target Pair
Thymidine kinase, cytosolic (Homo sapiens (Human))	BDBM50027352 (1-(4,5-Dihydroxy-tetrahydro-furan-2-yl)-5-methylsu...) Show SMILES CSc1cnc(=O)n(c1)C1CC(O)C(O)O1 Show InChI InChI=1S/C9H12N2O4S/c1-16-5-3-10-9(14)11(4-5)7-2-6(12)8(13)15-7/h3-4,6-8,12-13H,2H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	4.10E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for the binding affinity to thymidine kinase from Varicella zoster virus infected human cells				J Med Chem 24: 109-12 (1981) BindingDB Entry DOI: 10.7270/Q2DF6Q7X
					More data for this Ligand-Target Pair
Thymidine kinase, cytosolic (Homo sapiens (Human))	BDBM50027352 (1-(4,5-Dihydroxy-tetrahydro-furan-2-yl)-5-methylsu...) Show SMILES CSc1cnc(=O)n(c1)C1CC(O)C(O)O1 Show InChI InChI=1S/C9H12N2O4S/c1-16-5-3-10-9(14)11(4-5)7-2-6(12)8(13)15-7/h3-4,6-8,12-13H,2H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	1.60E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for the binding affinity to thymidine kinase from HeLa mitochondria				J Med Chem 24: 109-12 (1981) BindingDB Entry DOI: 10.7270/Q2DF6Q7X
					More data for this Ligand-Target Pair
Thymidine kinase, cytosolic (Homo sapiens (Human))	BDBM50027352 (1-(4,5-Dihydroxy-tetrahydro-furan-2-yl)-5-methylsu...) Show SMILES CSc1cnc(=O)n(c1)C1CC(O)C(O)O1 Show InChI InChI=1S/C9H12N2O4S/c1-16-5-3-10-9(14)11(4-5)7-2-6(12)8(13)15-7/h3-4,6-8,12-13H,2H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	>4.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for the binding affinity to thymidine kinase from HeLa cytosol				J Med Chem 24: 109-12 (1981) BindingDB Entry DOI: 10.7270/Q2DF6Q7X
					More data for this Ligand-Target Pair