Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Toll-like receptor 7' and Ligand = 'BDBM450167'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/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))	BDBM450167 (US10703755, Example 364) Show SMILES COc1nc(C)c2nc(-c3cncc(F)c3)n(Cc3cccc(c3)C3=CN4CCC3CC4)c2n1 |t:26,(-6.92,2.66,;-5.74,1.67,;-4.4,2.44,;-4.4,3.98,;-3.07,4.75,;-3.07,6.29,;-1.74,3.98,;-.27,4.46,;.63,3.21,;2.17,3.21,;2.94,1.88,;4.48,1.88,;5.25,3.21,;4.48,4.54,;5.25,5.88,;2.94,4.54,;-.27,1.96,;.13,.48,;1.62,.08,;2.7,1.17,;4.19,.77,;4.59,-.72,;3.5,-1.81,;2.01,-1.41,;3.9,-3.3,;2.78,-4.36,;3.14,-5.85,;3.83,-4.59,;4.57,-5.05,;5.38,-3.73,;5.74,-5.23,;4.62,-6.29,;-1.74,2.44,;-3.07,1.67,)| Show InChI InChI=1S/C26H25FN6O/c1-16-23-25(31-26(29-16)34-2)33(24(30-23)20-11-21(27)13-28-12-20)14-17-4-3-5-19(10-17)22-15-32-8-6-18(22)7-9-32/h3-5,10-13,15,18H,6-9,14H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	11	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) BindingDB Entry DOI: 10.7270/Q28W3HBW
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