BDBM50533428 CHEMBL4521406

SMILES: O(c1ccccc1)c1ccncc1-c1nn2cnnc2s1

InChI Key: InChIKey=ABGAWOONVPNDTR-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50533428   

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
Large T antigen (JC polyomavirus)	BDBM50533428 (CHEMBL4521406) Show SMILES O(c1ccccc1)c1ccncc1-c1nn2cnnc2s1 Show InChI InChI=1S/C14H9N5OS/c1-2-4-10(5-3-1)20-12-6-7-15-8-11(12)13-18-19-9-16-17-14(19)21-13/h1-9H	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Vertex Pharmaceuticals, Inc Curated by ChEMBL					Assay Description Inhibition of helicase activity of JC polyomavirus LTAg (E264 to D628 residues) expressed in Escherichia coli using Cy5/BHQ3 dsDNA pre-incubated for ...				J Med Chem 59: 7138-51 (2016) Article DOI: 10.1021/acs.jmedchem.6b00486
					More data for this Ligand-Target Pair