null

SMILES: CCOc1nc(C)c2nc(-c3cncc(F)c3)n(Cc3ccc([C@H]4CN5CCC4CC5)c(c3)C#N)c2n1

InChI Key: InChIKey=NXWPGKWUOARFBC-DEOSSOPVSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 450195   

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
Toll-like receptor 7 (Homo sapiens (Human))	BDBM450195 (US10703755, Example 395) Show SMILES CCOc1nc(C)c2nc(-c3cncc(F)c3)n(Cc3ccc([C@H]4CN5CCC4CC5)c(c3)C#N)c2n1 |r,wD:23.23,(-7.56,-13.3,;-6.22,-12.53,;-4.89,-13.3,;-3.56,-12.53,;-3.56,-10.99,;-2.22,-10.22,;-2.22,-8.68,;-.89,-10.99,;.57,-10.52,;1.48,-11.76,;3.02,-11.76,;3.79,-13.1,;5.33,-13.1,;6.1,-11.76,;5.33,-10.43,;6.1,-9.09,;3.79,-10.43,;.57,-13.01,;.97,-14.5,;2.46,-14.89,;3.55,-13.8,;5.04,-14.2,;5.44,-15.69,;6.92,-16.09,;7.32,-17.58,;8.81,-17.98,;9.9,-16.89,;9.5,-15.4,;8.01,-15,;8.01,-16.54,;8.81,-16.44,;4.36,-16.83,;2.86,-16.38,;4.76,-18.32,;5.16,-19.81,;-.89,-12.53,;-2.22,-13.3,)| Show InChI InChI=1S/C28H28FN7O/c1-3-37-28-32-17(2)25-27(34-28)36(26(33-25)21-11-22(29)14-31-13-21)15-18-4-5-23(20(10-18)12-30)24-16-35-8-6-19(24)7-9-35/h4-5,10-11,13-14,19,24H,3,6-9,15-16H2,1-2H3/t24-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
SUMITOMO DAINIPPON PHARMA CO., LTD. US Patent					Assay Description As human TLR7 expressing cell line, HEK293 cell line was bought from IMGENEX Corporation (TLR7/NF-ηB/SEAPorter™ HEK293 cell), which is human emb...				US Patent US10703755 (2020)
					More data for this Ligand-Target Pair