BDBM50229856 CHEMBL102001

SMILES: Oc1[nH]c(Nc2cccc(CN=[N+]=[N-])c2)nc2ncnc12

InChI Key: InChIKey=HGLYMNPJNOVACJ-UHFFFAOYSA-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 = 50229856   

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 (strain SC16) (HHV-1) (Human h...)	BDBM50229856 (CHEMBL102001) Show SMILES Oc1[nH]c(Nc2cccc(CN=[N+]=[N-])c2)nc2ncnc12 Show InChI InChI=1S/C12H10N8O/c13-20-16-5-7-2-1-3-8(4-7)17-12-18-10-9(11(21)19-12)14-6-15-10/h1-4,6H,5H2,(H3,14,15,17,18,19,21)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	794	n/a	n/a	n/a	n/a	n/a	n/a
University of Massachusetts Medical School Curated by ChEMBL					Assay Description Inhibitory activity against HSV-1 thymidine kinase isolated from HeLa cells				J Med Chem 35: 2979-83 (1992) BindingDB Entry DOI: 10.7270/Q29G5Q2Q
					More data for this Ligand-Target Pair
Thymidine kinase (Human herpesvirus 2)	BDBM50229856 (CHEMBL102001) Show SMILES Oc1[nH]c(Nc2cccc(CN=[N+]=[N-])c2)nc2ncnc12 Show InChI InChI=1S/C12H10N8O/c13-20-16-5-7-2-1-3-8(4-7)17-12-18-10-9(11(21)19-12)14-6-15-10/h1-4,6H,5H2,(H3,14,15,17,18,19,21)	KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.51E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Massachusetts Medical School Curated by ChEMBL					Assay Description Inhibitory activity against HSV-2 thymidine kinase isolated from HeLa cells				J Med Chem 35: 2979-83 (1992) BindingDB Entry DOI: 10.7270/Q29G5Q2Q
					More data for this Ligand-Target Pair