BDBM289740 US10093671, Example 9

SMILES: COCCCOc1cc2CC(c3ccc(F)cc3)n3cc(C(O)=O)c(=O)cc3-c2cc1OC

InChI Key: InChIKey=BTSLQZIWAUZNPO-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 = 289740   

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 envelope protein (Hepatitis B virus)	BDBM289740 (US10093671, Example 9) Show SMILES COCCCOc1cc2CC(c3ccc(F)cc3)n3cc(C(O)=O)c(=O)cc3-c2cc1OC Show InChI InChI=1S/C25H24FNO6/c1-31-8-3-9-33-24-11-16-10-20(15-4-6-17(26)7-5-15)27-14-19(25(29)30)22(28)13-21(27)18(16)12-23(24)32-2/h4-7,11-14,20H,3,8-10H2,1-2H3,(H,29,30)	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	83	n/a	n/a	n/a	n/a	n/a	25
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 US10093671 (2018) BindingDB Entry DOI: 10.7270/Q21838KR
					More data for this Ligand-Target Pair