Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Toll-like receptor 7' and Ligand = 'BDBM427762'   

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))	BDBM427762 (US10544143, Example 195 | US10544143, Example 199) Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2ccc(nc2c1C(C)C)C1CCC(CC1)N1CCCC1 |(9.38,.97,;7.84,.97,;7.07,-.36,;5.53,-.36,;4.76,-1.69,;5.53,-3.03,;7.07,-3.03,;8.1,-4.17,;9.51,-3.55,;9.35,-2.01,;7.84,-1.69,;3.22,-1.69,;2.31,-2.94,;.85,-2.46,;-.48,-3.23,;-1.82,-2.46,;-1.82,-.92,;-.48,-.15,;.85,-.92,;2.31,-.45,;2.71,1.04,;1.62,2.13,;4.2,1.44,;-3.15,-.15,;-4.49,-.92,;-5.82,-.15,;-5.82,1.39,;-4.49,2.16,;-3.15,1.39,;-7.15,2.16,;-7.14,3.7,;-8.6,4.17,;-9.51,2.93,;-8.6,1.68,)| Show InChI InChI=1S/C27H34N6O/c1-17(2)24-25(19-14-23(34-3)27-28-16-29-33(27)15-19)31-22-11-10-21(30-26(22)24)18-6-8-20(9-7-18)32-12-4-5-13-32/h10-11,14-18,20,31H,4-9,12-13H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.160	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...				US Patent US10544143 (2020) BindingDB Entry DOI: 10.7270/Q2QF8W80
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM427762 (US10544143, Example 195 | US10544143, Example 199) Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2ccc(nc2c1C(C)C)C1CCC(CC1)N1CCCC1 |(9.38,.97,;7.84,.97,;7.07,-.36,;5.53,-.36,;4.76,-1.69,;5.53,-3.03,;7.07,-3.03,;8.1,-4.17,;9.51,-3.55,;9.35,-2.01,;7.84,-1.69,;3.22,-1.69,;2.31,-2.94,;.85,-2.46,;-.48,-3.23,;-1.82,-2.46,;-1.82,-.92,;-.48,-.15,;.85,-.92,;2.31,-.45,;2.71,1.04,;1.62,2.13,;4.2,1.44,;-3.15,-.15,;-4.49,-.92,;-5.82,-.15,;-5.82,1.39,;-4.49,2.16,;-3.15,1.39,;-7.15,2.16,;-7.14,3.7,;-8.6,4.17,;-9.51,2.93,;-8.6,1.68,)| Show InChI InChI=1S/C27H34N6O/c1-17(2)24-25(19-14-23(34-3)27-28-16-29-33(27)15-19)31-22-11-10-21(30-26(22)24)18-6-8-20(9-7-18)32-12-4-5-13-32/h10-11,14-18,20,31H,4-9,12-13H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.800	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...				US Patent US10544143 (2020) BindingDB Entry DOI: 10.7270/Q2QF8W80
					More data for this Ligand-Target Pair