BDBM333112 US10196391, Example 112

SMILES: COc1cc(cc(F)n1)N1CCc2nc(ncc2C1)-c1ncccn1

InChI Key: InChIKey=BBIHQKJIKXNHTK-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 = 333112   

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
Hepatitis GB virus B NS5B RNA-dependent RNA polymerase (Hepatitis GB virus B)	BDBM333112 (US10196391, Example 112) Show SMILES COc1cc(cc(F)n1)N1CCc2nc(ncc2C1)-c1ncccn1 Show InChI InChI=1S/C17H15FN6O/c1-25-15-8-12(7-14(18)23-15)24-6-3-13-11(10-24)9-21-17(22-13)16-19-4-2-5-20-16/h2,4-5,7-9H,3,6,10H2,1H3	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	553	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description HepG2.2.15 cells were seeded in duplicate into white, 96-well plates at 1.5×104 cells/well. The cells were treated with a three-fold serial dilution ...				US Patent US10196391 (2019) BindingDB Entry DOI: 10.7270/Q2XK8HNM
					More data for this Ligand-Target Pair