BDBM333106 US10196391, Example 106

SMILES: COCCCNC(=O)c1cc(F)cc(c1)N1CCc2nc(ncc2C1)-c1ncccn1

InChI Key: InChIKey=WHXBADLYTUTWRK-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 = 333106   

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)	BDBM333106 (US10196391, Example 106) Show SMILES COCCCNC(=O)c1cc(F)cc(c1)N1CCc2nc(ncc2C1)-c1ncccn1 Show InChI InChI=1S/C22H23FN6O2/c1-31-9-3-7-26-22(30)15-10-17(23)12-18(11-15)29-8-4-19-16(14-29)13-27-21(28-19)20-24-5-2-6-25-20/h2,5-6,10-13H,3-4,7-9,14H2,1H3,(H,26,30)	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.34E+3	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