Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Toll-like receptor 7' and Ligand = 'BDBM419243'   

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))	BDBM419243 (US10457681, Compound Ia-05 | US10487084, Compound ...) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3ccc4N(C)c5ccc(CNC6COC6)cc5Sc4c3)c2n1 Show InChI InChI=1S/C27H31N7O3S/c1-3-4-9-37-26-31-24(28)23-25(32-26)34(27(35)30-23)13-17-6-8-20-22(11-17)38-21-10-16(5-7-19(21)33(20)2)12-29-18-14-36-15-18/h5-8,10-11,18,29H,3-4,9,12-15H2,1-2H3,(H,30,35)(H2,28,31,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	8	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description Engineered human embryonic kidney blue cells (HEK-Blue TLR cells; Invivogen) possessing a human TLR7-secreted embryonic alkaline phosphatase (SEAP) r...				US Patent US10487084 (2019) BindingDB Entry DOI: 10.7270/Q2P55QX7
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM419243 (US10457681, Compound Ia-05 | US10487084, Compound ...) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3ccc4N(C)c5ccc(CNC6COC6)cc5Sc4c3)c2n1 Show InChI InChI=1S/C27H31N7O3S/c1-3-4-9-37-26-31-24(28)23-25(32-26)34(27(35)30-23)13-17-6-8-20-22(11-17)38-21-10-16(5-7-19(21)33(20)2)12-29-18-14-36-15-18/h5-8,10-11,18,29H,3-4,9,12-15H2,1-2H3,(H,30,35)(H2,28,31,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	580	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Companay US Patent					Assay Description Engineered human embryonic kidney blue cells (HEK-Blue™ TLR cells; Invivogen) possessing a human TLR7-secreted embryonic alkaline phosphatase (SEAP) ...				US Patent US10981914 (2021) BindingDB Entry DOI: 10.7270/Q23X89RG
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM419243 (US10457681, Compound Ia-05 | US10487084, Compound ...) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3ccc4N(C)c5ccc(CNC6COC6)cc5Sc4c3)c2n1 Show InChI InChI=1S/C27H31N7O3S/c1-3-4-9-37-26-31-24(28)23-25(32-26)34(27(35)30-23)13-17-6-8-20-22(11-17)38-21-10-16(5-7-19(21)33(20)2)12-29-18-14-36-15-18/h5-8,10-11,18,29H,3-4,9,12-15H2,1-2H3,(H,30,35)(H2,28,31,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	580	n/a	n/a	n/a	n/a
Bristol_Myers Squibb Company US Patent					Assay Description Engineered human embryonic kidney blue cells (HEK-Blue TLR cells; Invivogen) possessing a human TLR7-secreted embryonic alkaline phosphatase (SEAP) r...				US Patent US10457681 (2019) BindingDB Entry DOI: 10.7270/Q2N87D54
					More data for this Ligand-Target Pair