Compile Data Set for Download or QSAR

Found 66 hits Enz. Inhib. hit(s) with all data for entry = 9707   

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))	BDBM50241029 (1-[4-amino-2-(ethoxymethyl)-1H-imidazo[4,5-c]quino...) Show SMILES CCOCc1nc2c(N)nc3ccccc3c2n1CC(C)(C)O Show InChI InChI=1S/C17H22N4O2/c1-4-23-9-13-20-14-15(21(13)10-17(2,3)22)11-7-5-6-8-12(11)19-16(14)18/h5-8,22H,4,9-10H2,1-3H3,(H2,18,19)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents	PDB US Patent	n/a	n/a	n/a	n/a	330	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair				3D Structure (crystal)
Toll-like receptor 7 (Homo sapiens (Human))	BDBM50440284 (CHEMBL2424780 | US10457681, Compound Vesatolimod |...) Show SMILES CCCCOc1nc(N)c2NC(=O)CN(Cc3cccc(CN4CCCC4)c3)c2n1 Show InChI InChI=1S/C22H30N6O2/c1-2-3-11-30-22-25-20(23)19-21(26-22)28(15-18(29)24-19)14-17-8-6-7-16(12-17)13-27-9-4-5-10-27/h6-8,12H,2-5,9-11,13-15H2,1H3,(H,24,29)(H2,23,25,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem	PDB US Patent	n/a	n/a	n/a	n/a	1.20E+3	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair				3D Structure (crystal)
Toll-like receptor 7 (Homo sapiens (Human))	BDBM50320067 (1-(4-amino-2-((ethylamino)methyl)-1H-imidazo[4,5-c...) Show SMILES CCNCc1nc2c(N)nc3ccccc3c2n1CC(C)(C)O Show InChI InChI=1S/C17H23N5O/c1-4-19-9-13-21-14-15(22(13)10-17(2,3)23)11-7-5-6-8-12(11)20-16(14)18/h5-8,19,23H,4,9-10H2,1-3H3,(H2,18,20)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	PDB US Patent	n/a	n/a	n/a	n/a	3.34E+3	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair				3D Structure (crystal)
Toll-like receptor 7 (Homo sapiens (Human))	BDBM419191 (US10457681, Compound B | US10487084, Compound B | ...) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3ccccc3)c2n1 Show InChI InChI=1S/C16H19N5O2/c1-2-3-9-23-15-19-13(17)12-14(20-15)21(16(22)18-12)10-11-7-5-4-6-8-11/h4-8H,2-3,9-10H2,1H3,(H,18,22)(H2,17,19,20)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	470	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM483317 (US10919895, Compound Ia-01) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3cnc(CNCc4ccncc4)cn3)c2n1 Show InChI InChI=1S/C21H25N9O2/c1-2-3-8-32-20-28-18(22)17-19(29-20)30(21(31)27-17)13-16-12-25-15(11-26-16)10-24-9-14-4-6-23-7-5-14/h4-7,11-12,24H,2-3,8-10,13H2,1H3,(H,27,31)(H2,22,28,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	330	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Interleukin-6 (Homo sapiens (Human))	BDBM483317 (US10919895, Compound Ia-01) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3cnc(CNCc4ccncc4)cn3)c2n1 Show InChI InChI=1S/C21H25N9O2/c1-2-3-8-32-20-28-18(22)17-19(29-20)30(21(31)27-17)13-16-12-25-15(11-26-16)10-24-9-14-4-6-23-7-5-14/h4-7,11-12,24H,2-3,8-10,13H2,1H3,(H,27,31)(H2,22,28,29)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description Compounds diluted in DMSO were transferred to individual wells of a Matrix Technologies clear, V-bottom 384-well plate using ECHO acoustic liquid han...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM483318 (US10919895, Compound Ia-02) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3cnc(CNCC4COC4)cn3)c2n1 Show InChI InChI=1S/C19H26N8O3/c1-2-3-4-30-18-25-16(20)15-17(26-18)27(19(28)24-15)9-14-8-22-13(7-23-14)6-21-5-12-10-29-11-12/h7-8,12,21H,2-6,9-11H2,1H3,(H,24,28)(H2,20,25,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	1.12E+4	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM483319 (US10919895, Compound Ia-03) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3cnc(CNCc4ccccc4)cn3)c2n1 Show InChI InChI=1S/C22H26N8O2/c1-2-3-9-32-21-28-19(23)18-20(29-21)30(22(31)27-18)14-17-13-25-16(12-26-17)11-24-10-15-7-5-4-6-8-15/h4-8,12-13,24H,2-3,9-11,14H2,1H3,(H,27,31)(H2,23,28,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	180	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Interleukin-6 (Homo sapiens (Human))	BDBM483319 (US10919895, Compound Ia-03) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3cnc(CNCc4ccccc4)cn3)c2n1 Show InChI InChI=1S/C22H26N8O2/c1-2-3-9-32-21-28-19(23)18-20(29-21)30(22(31)27-18)14-17-13-25-16(12-26-17)11-24-10-15-7-5-4-6-8-15/h4-8,12-13,24H,2-3,9-11,14H2,1H3,(H,27,31)(H2,23,28,29)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description Compounds diluted in DMSO were transferred to individual wells of a Matrix Technologies clear, V-bottom 384-well plate using ECHO acoustic liquid han...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM483320 (US10919895, Compound Ia-04) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3cnc(CNCCOC)cn3)c2n1 Show InChI InChI=1S/C18H26N8O3/c1-3-4-6-29-17-24-15(19)14-16(25-17)26(18(27)23-14)11-13-10-21-12(9-22-13)8-20-5-7-28-2/h9-10,20H,3-8,11H2,1-2H3,(H,23,27)(H2,19,24,25)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	310	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Interleukin-6 (Homo sapiens (Human))	BDBM483320 (US10919895, Compound Ia-04) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3cnc(CNCCOC)cn3)c2n1 Show InChI InChI=1S/C18H26N8O3/c1-3-4-6-29-17-24-15(19)14-16(25-17)26(18(27)23-14)11-13-10-21-12(9-22-13)8-20-5-7-28-2/h9-10,20H,3-8,11H2,1-2H3,(H,23,27)(H2,19,24,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	600	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description Compounds diluted in DMSO were transferred to individual wells of a Matrix Technologies clear, V-bottom 384-well plate using ECHO acoustic liquid han...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM483321 (US10919895, Compound Ia-05) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3cnc(CNC4CC4)cn3)c2n1 Show InChI InChI=1S/C18H24N8O2/c1-2-3-6-28-17-24-15(19)14-16(25-17)26(18(27)23-14)10-13-9-21-12(8-22-13)7-20-11-4-5-11/h8-9,11,20H,2-7,10H2,1H3,(H,23,27)(H2,19,24,25)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	140	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Interleukin-6 (Homo sapiens (Human))	BDBM483321 (US10919895, Compound Ia-05) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3cnc(CNC4CC4)cn3)c2n1 Show InChI InChI=1S/C18H24N8O2/c1-2-3-6-28-17-24-15(19)14-16(25-17)26(18(27)23-14)10-13-9-21-12(8-22-13)7-20-11-4-5-11/h8-9,11,20H,2-7,10H2,1H3,(H,23,27)(H2,19,24,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	360	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description Compounds diluted in DMSO were transferred to individual wells of a Matrix Technologies clear, V-bottom 384-well plate using ECHO acoustic liquid han...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM483322 (US10919895, Compound Ia-06) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3cnc(CNC(C)C)cn3)c2n1 Show InChI InChI=1S/C18H26N8O2/c1-4-5-6-28-17-24-15(19)14-16(25-17)26(18(27)23-14)10-13-9-21-12(8-22-13)7-20-11(2)3/h8-9,11,20H,4-7,10H2,1-3H3,(H,23,27)(H2,19,24,25)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	83	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Interleukin-6 (Homo sapiens (Human))	BDBM483322 (US10919895, Compound Ia-06) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3cnc(CNC(C)C)cn3)c2n1 Show InChI InChI=1S/C18H26N8O2/c1-4-5-6-28-17-24-15(19)14-16(25-17)26(18(27)23-14)10-13-9-21-12(8-22-13)7-20-11(2)3/h8-9,11,20H,4-7,10H2,1-3H3,(H,23,27)(H2,19,24,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	210	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description Compounds diluted in DMSO were transferred to individual wells of a Matrix Technologies clear, V-bottom 384-well plate using ECHO acoustic liquid han...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM483323 (US10919895, Compound Ia-07) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3cnc(CNC4COC4)cn3)c2n1 Show InChI InChI=1S/C18H24N8O3/c1-2-3-4-29-17-24-15(19)14-16(25-17)26(18(27)23-14)8-12-7-20-11(5-21-12)6-22-13-9-28-10-13/h5,7,13,22H,2-4,6,8-10H2,1H3,(H,23,27)(H2,19,24,25)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	490	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Interleukin-6 (Homo sapiens (Human))	BDBM483323 (US10919895, Compound Ia-07) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3cnc(CNC4COC4)cn3)c2n1 Show InChI InChI=1S/C18H24N8O3/c1-2-3-4-29-17-24-15(19)14-16(25-17)26(18(27)23-14)8-12-7-20-11(5-21-12)6-22-13-9-28-10-13/h5,7,13,22H,2-4,6,8-10H2,1H3,(H,23,27)(H2,19,24,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description Compounds diluted in DMSO were transferred to individual wells of a Matrix Technologies clear, V-bottom 384-well plate using ECHO acoustic liquid han...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM483324 (US10919895, Compound Ia-08) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3cnc(CNC4CCC4)cn3)c2n1 Show InChI InChI=1S/C19H26N8O2/c1-2-3-7-29-18-25-16(20)15-17(26-18)27(19(28)24-15)11-14-10-22-13(9-23-14)8-21-12-5-4-6-12/h9-10,12,21H,2-8,11H2,1H3,(H,24,28)(H2,20,25,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	24	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Interleukin-6 (Homo sapiens (Human))	BDBM483324 (US10919895, Compound Ia-08) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3cnc(CNC4CCC4)cn3)c2n1 Show InChI InChI=1S/C19H26N8O2/c1-2-3-7-29-18-25-16(20)15-17(26-18)27(19(28)24-15)11-14-10-22-13(9-23-14)8-21-12-5-4-6-12/h9-10,12,21H,2-8,11H2,1H3,(H,24,28)(H2,20,25,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	220	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description Compounds diluted in DMSO were transferred to individual wells of a Matrix Technologies clear, V-bottom 384-well plate using ECHO acoustic liquid han...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM483325 (US10919895, Compound Ia-09) Show SMILES CCCCNCc1cnc(Cn2c(O)nc3c(N)nc(OCCCC)nc23)cn1 Show InChI InChI=1S/C19H28N8O2/c1-3-5-7-21-9-13-10-23-14(11-22-13)12-27-17-15(24-19(27)28)16(20)25-18(26-17)29-8-6-4-2/h10-11,21H,3-9,12H2,1-2H3,(H,24,28)(H2,20,25,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	89	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Interleukin-6 (Homo sapiens (Human))	BDBM483325 (US10919895, Compound Ia-09) Show SMILES CCCCNCc1cnc(Cn2c(O)nc3c(N)nc(OCCCC)nc23)cn1 Show InChI InChI=1S/C19H28N8O2/c1-3-5-7-21-9-13-10-23-14(11-22-13)12-27-17-15(24-19(27)28)16(20)25-18(26-17)29-8-6-4-2/h10-11,21H,3-9,12H2,1-2H3,(H,24,28)(H2,20,25,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	420	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description Compounds diluted in DMSO were transferred to individual wells of a Matrix Technologies clear, V-bottom 384-well plate using ECHO acoustic liquid han...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM483326 (US10919895, Compound Ia-10) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3cnc(CNC)cn3)c2n1 Show InChI InChI=1S/C16H22N8O2/c1-3-4-5-26-15-22-13(17)12-14(23-15)24(16(25)21-12)9-11-8-19-10(6-18-2)7-20-11/h7-8,18H,3-6,9H2,1-2H3,(H,21,25)(H2,17,22,23)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	290	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Interleukin-6 (Homo sapiens (Human))	BDBM483326 (US10919895, Compound Ia-10) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3cnc(CNC)cn3)c2n1 Show InChI InChI=1S/C16H22N8O2/c1-3-4-5-26-15-22-13(17)12-14(23-15)24(16(25)21-12)9-11-8-19-10(6-18-2)7-20-11/h7-8,18H,3-6,9H2,1-2H3,(H,21,25)(H2,17,22,23)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	570	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description Compounds diluted in DMSO were transferred to individual wells of a Matrix Technologies clear, V-bottom 384-well plate using ECHO acoustic liquid han...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM483327 (US10919895, Compound Ia-11) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3cnc(CNCCN)cn3)c2n1 Show InChI InChI=1S/C17H25N9O2/c1-2-3-6-28-16-24-14(19)13-15(25-16)26(17(27)23-13)10-12-9-21-11(8-22-12)7-20-5-4-18/h8-9,20H,2-7,10,18H2,1H3,(H,23,27)(H2,19,24,25)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	770	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM483328 (US10919895, Compound Ia-12) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3cnc(CNCCCOCCOCCOCCCNC(=O)OC(C)(C)C)cn3)c2n1 Show InChI InChI=1S/C30H49N9O7/c1-5-6-13-45-27-37-25(31)24-26(38-27)39(28(40)36-24)21-23-20-34-22(19-35-23)18-32-9-7-11-42-14-16-44-17-15-43-12-8-10-33-29(41)46-30(2,3)4/h19-20,32H,5-18,21H2,1-4H3,(H,33,41)(H,36,40)(H2,31,37,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	300	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM483329 (US10919895, Compound Ib-01) Show SMILES CCCCNCc1ccc(Cn2c(O)nc3c(N)nc(OCCCC)nc23)nc1 Show InChI InChI=1S/C20H29N7O2/c1-3-5-9-22-11-14-7-8-15(23-12-14)13-27-18-16(24-20(27)28)17(21)25-19(26-18)29-10-6-4-2/h7-8,12,22H,3-6,9-11,13H2,1-2H3,(H,24,28)(H2,21,25,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	15	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Interleukin-6 (Homo sapiens (Human))	BDBM483329 (US10919895, Compound Ib-01) Show SMILES CCCCNCc1ccc(Cn2c(O)nc3c(N)nc(OCCCC)nc23)nc1 Show InChI InChI=1S/C20H29N7O2/c1-3-5-9-22-11-14-7-8-15(23-12-14)13-27-18-16(24-20(27)28)17(21)25-19(26-18)29-10-6-4-2/h7-8,12,22H,3-6,9-11,13H2,1-2H3,(H,24,28)(H2,21,25,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	77	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description Compounds diluted in DMSO were transferred to individual wells of a Matrix Technologies clear, V-bottom 384-well plate using ECHO acoustic liquid han...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM483330 (US10919895, Compound Ib-02) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3ccc(CNCCOC)cn3)c2n1 Show InChI InChI=1S/C19H27N7O3/c1-3-4-8-29-18-24-16(20)15-17(25-18)26(19(27)23-15)12-14-6-5-13(11-22-14)10-21-7-9-28-2/h5-6,11,21H,3-4,7-10,12H2,1-2H3,(H,23,27)(H2,20,24,25)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	28	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Interleukin-6 (Homo sapiens (Human))	BDBM483330 (US10919895, Compound Ib-02) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3ccc(CNCCOC)cn3)c2n1 Show InChI InChI=1S/C19H27N7O3/c1-3-4-8-29-18-24-16(20)15-17(25-18)26(19(27)23-15)12-14-6-5-13(11-22-14)10-21-7-9-28-2/h5-6,11,21H,3-4,7-10,12H2,1-2H3,(H,23,27)(H2,20,24,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	110	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description Compounds diluted in DMSO were transferred to individual wells of a Matrix Technologies clear, V-bottom 384-well plate using ECHO acoustic liquid han...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM483331 (US10919895, Compound Ib-03) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3ccc(CNC4CC4)cn3)c2n1 Show InChI InChI=1S/C19H25N7O2/c1-2-3-8-28-18-24-16(20)15-17(25-18)26(19(27)23-15)11-14-5-4-12(10-22-14)9-21-13-6-7-13/h4-5,10,13,21H,2-3,6-9,11H2,1H3,(H,23,27)(H2,20,24,25)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	18	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Interleukin-6 (Homo sapiens (Human))	BDBM483331 (US10919895, Compound Ib-03) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3ccc(CNC4CC4)cn3)c2n1 Show InChI InChI=1S/C19H25N7O2/c1-2-3-8-28-18-24-16(20)15-17(25-18)26(19(27)23-15)11-14-5-4-12(10-22-14)9-21-13-6-7-13/h4-5,10,13,21H,2-3,6-9,11H2,1H3,(H,23,27)(H2,20,24,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	62	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description Compounds diluted in DMSO were transferred to individual wells of a Matrix Technologies clear, V-bottom 384-well plate using ECHO acoustic liquid han...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM483332 (US10919895, Compound Ib-04) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3ccc(CNC4CCC4)cn3)c2n1 Show InChI InChI=1S/C20H27N7O2/c1-2-3-9-29-19-25-17(21)16-18(26-19)27(20(28)24-16)12-15-8-7-13(11-23-15)10-22-14-5-4-6-14/h7-8,11,14,22H,2-6,9-10,12H2,1H3,(H,24,28)(H2,21,25,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	12	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Interleukin-6 (Homo sapiens (Human))	BDBM483332 (US10919895, Compound Ib-04) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3ccc(CNC4CCC4)cn3)c2n1 Show InChI InChI=1S/C20H27N7O2/c1-2-3-9-29-19-25-17(21)16-18(26-19)27(20(28)24-16)12-15-8-7-13(11-23-15)10-22-14-5-4-6-14/h7-8,11,14,22H,2-6,9-10,12H2,1H3,(H,24,28)(H2,21,25,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	78	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description Compounds diluted in DMSO were transferred to individual wells of a Matrix Technologies clear, V-bottom 384-well plate using ECHO acoustic liquid han...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM483333 (US10919895, Compound Ib-05) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3ccc(CNCCCN)cn3)c2n1 Show InChI InChI=1S/C19H28N8O2/c1-2-3-9-29-18-25-16(21)15-17(26-18)27(19(28)24-15)12-14-6-5-13(11-23-14)10-22-8-4-7-20/h5-6,11,22H,2-4,7-10,12,20H2,1H3,(H,24,28)(H2,21,25,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	62	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Interleukin-6 (Homo sapiens (Human))	BDBM483333 (US10919895, Compound Ib-05) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3ccc(CNCCCN)cn3)c2n1 Show InChI InChI=1S/C19H28N8O2/c1-2-3-9-29-18-25-16(21)15-17(26-18)27(19(28)24-15)12-14-6-5-13(11-23-14)10-22-8-4-7-20/h5-6,11,22H,2-4,7-10,12,20H2,1H3,(H,24,28)(H2,21,25,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	260	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description Compounds diluted in DMSO were transferred to individual wells of a Matrix Technologies clear, V-bottom 384-well plate using ECHO acoustic liquid han...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM483334 (US10919895, Compound Ib-06) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3ccc(CNCc4ccccc4)cn3)c2n1 Show InChI InChI=1S/C23H27N7O2/c1-2-3-11-32-22-28-20(24)19-21(29-22)30(23(31)27-19)15-18-10-9-17(14-26-18)13-25-12-16-7-5-4-6-8-16/h4-10,14,25H,2-3,11-13,15H2,1H3,(H,27,31)(H2,24,28,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	22	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Interleukin-6 (Homo sapiens (Human))	BDBM483334 (US10919895, Compound Ib-06) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3ccc(CNCc4ccccc4)cn3)c2n1 Show InChI InChI=1S/C23H27N7O2/c1-2-3-11-32-22-28-20(24)19-21(29-22)30(23(31)27-19)15-18-10-9-17(14-26-18)13-25-12-16-7-5-4-6-8-16/h4-10,14,25H,2-3,11-13,15H2,1H3,(H,27,31)(H2,24,28,29)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	190	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description Compounds diluted in DMSO were transferred to individual wells of a Matrix Technologies clear, V-bottom 384-well plate using ECHO acoustic liquid han...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM483335 (US10919895, Compound Ib-07) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3ccc(CNCc4ccc(N)cc4)cn3)c2n1 Show InChI InChI=1S/C23H28N8O2/c1-2-3-10-33-22-29-20(25)19-21(30-22)31(23(32)28-19)14-18-9-6-16(13-27-18)12-26-11-15-4-7-17(24)8-5-15/h4-9,13,26H,2-3,10-12,14,24H2,1H3,(H,28,32)(H2,25,29,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	41	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Interleukin-6 (Homo sapiens (Human))	BDBM483335 (US10919895, Compound Ib-07) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3ccc(CNCc4ccc(N)cc4)cn3)c2n1 Show InChI InChI=1S/C23H28N8O2/c1-2-3-10-33-22-29-20(25)19-21(30-22)31(23(32)28-19)14-18-9-6-16(13-27-18)12-26-11-15-4-7-17(24)8-5-15/h4-9,13,26H,2-3,10-12,14,24H2,1H3,(H,28,32)(H2,25,29,30)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	100	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description Compounds diluted in DMSO were transferred to individual wells of a Matrix Technologies clear, V-bottom 384-well plate using ECHO acoustic liquid han...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM483336 (US10919895, Compound Ib-08) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3ccc(CNCCCOCCOCCOCCCNC(=O)OC(C)(C)C)cn3)c2n1 Show InChI InChI=1S/C31H50N8O7/c1-5-6-15-45-28-37-26(32)25-27(38-28)39(29(40)36-25)22-24-10-9-23(21-35-24)20-33-11-7-13-42-16-18-44-19-17-43-14-8-12-34-30(41)46-31(2,3)4/h9-10,21,33H,5-8,11-20,22H2,1-4H3,(H,34,41)(H,36,40)(H2,32,37,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	47	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Interleukin-6 (Homo sapiens (Human))	BDBM483336 (US10919895, Compound Ib-08) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3ccc(CNCCCOCCOCCOCCCNC(=O)OC(C)(C)C)cn3)c2n1 Show InChI InChI=1S/C31H50N8O7/c1-5-6-15-45-28-37-26(32)25-27(38-28)39(29(40)36-25)22-24-10-9-23(21-35-24)20-33-11-7-13-42-16-18-44-19-17-43-14-8-12-34-30(41)46-31(2,3)4/h9-10,21,33H,5-8,11-20,22H2,1-4H3,(H,34,41)(H,36,40)(H2,32,37,38)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	330	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description Compounds diluted in DMSO were transferred to individual wells of a Matrix Technologies clear, V-bottom 384-well plate using ECHO acoustic liquid han...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM483337 (US10919895, Compound Ic-01) Show SMILES CCCCNCc1ccc(Cn2c(O)nc3c(N)nc(OCCCC)nc23)cn1 Show InChI InChI=1S/C20H29N7O2/c1-3-5-9-22-12-15-8-7-14(11-23-15)13-27-18-16(24-20(27)28)17(21)25-19(26-18)29-10-6-4-2/h7-8,11,22H,3-6,9-10,12-13H2,1-2H3,(H,24,28)(H2,21,25,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	4.80	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Interleukin-6 (Homo sapiens (Human))	BDBM483337 (US10919895, Compound Ic-01) Show SMILES CCCCNCc1ccc(Cn2c(O)nc3c(N)nc(OCCCC)nc23)cn1 Show InChI InChI=1S/C20H29N7O2/c1-3-5-9-22-12-15-8-7-14(11-23-15)13-27-18-16(24-20(27)28)17(21)25-19(26-18)29-10-6-4-2/h7-8,11,22H,3-6,9-10,12-13H2,1-2H3,(H,24,28)(H2,21,25,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	26	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description Compounds diluted in DMSO were transferred to individual wells of a Matrix Technologies clear, V-bottom 384-well plate using ECHO acoustic liquid han...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM483338 (US10919895, Compound Ic-02) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3ccc(CNCCOC)nc3)c2n1 Show InChI InChI=1S/C19H27N7O3/c1-3-4-8-29-18-24-16(20)15-17(25-18)26(19(27)23-15)12-13-5-6-14(22-10-13)11-21-7-9-28-2/h5-6,10,21H,3-4,7-9,11-12H2,1-2H3,(H,23,27)(H2,20,24,25)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	9	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM483339 (US10919895, Compound Ic-03) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3ccc(CNC4CC4)nc3)c2n1 Show InChI InChI=1S/C19H25N7O2/c1-2-3-8-28-18-24-16(20)15-17(25-18)26(19(27)23-15)11-12-4-5-14(21-9-12)10-22-13-6-7-13/h4-5,9,13,22H,2-3,6-8,10-11H2,1H3,(H,23,27)(H2,20,24,25)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	5.30	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Interleukin-6 (Homo sapiens (Human))	BDBM483339 (US10919895, Compound Ic-03) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3ccc(CNC4CC4)nc3)c2n1 Show InChI InChI=1S/C19H25N7O2/c1-2-3-8-28-18-24-16(20)15-17(25-18)26(19(27)23-15)11-12-4-5-14(21-9-12)10-22-13-6-7-13/h4-5,9,13,22H,2-3,6-8,10-11H2,1H3,(H,23,27)(H2,20,24,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	14	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description Compounds diluted in DMSO were transferred to individual wells of a Matrix Technologies clear, V-bottom 384-well plate using ECHO acoustic liquid han...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM483340 (US10919895, Compound Ic-04) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3ccc(CNC4CCC4)cc3)c2n1 Show InChI InChI=1S/C21H28N6O2/c1-2-3-11-29-20-25-18(22)17-19(26-20)27(21(28)24-17)13-15-9-7-14(8-10-15)12-23-16-5-4-6-16/h7-10,16,23H,2-6,11-13H2,1H3,(H,24,28)(H2,22,25,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	3.60	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Interleukin-6 (Homo sapiens (Human))	BDBM483340 (US10919895, Compound Ic-04) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3ccc(CNC4CCC4)cc3)c2n1 Show InChI InChI=1S/C21H28N6O2/c1-2-3-11-29-20-25-18(22)17-19(26-20)27(21(28)24-17)13-15-9-7-14(8-10-15)12-23-16-5-4-6-16/h7-10,16,23H,2-6,11-13H2,1H3,(H,24,28)(H2,22,25,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	22	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description Compounds diluted in DMSO were transferred to individual wells of a Matrix Technologies clear, V-bottom 384-well plate using ECHO acoustic liquid han...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM483341 (US10919895, Compound Ic-05) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3ccc(CNCCCN)nc3)c2n1 Show InChI InChI=1S/C19H28N8O2/c1-2-3-9-29-18-25-16(21)15-17(26-18)27(19(28)24-15)12-13-5-6-14(23-10-13)11-22-8-4-7-20/h5-6,10,22H,2-4,7-9,11-12,20H2,1H3,(H,24,28)(H2,21,25,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	14	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) ...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair
Interleukin-6 (Homo sapiens (Human))	BDBM483341 (US10919895, Compound Ic-05) Show SMILES CCCCOc1nc(N)c2nc(O)n(Cc3ccc(CNCCCN)nc3)c2n1 Show InChI InChI=1S/C19H28N8O2/c1-2-3-9-29-18-25-16(21)15-17(26-18)27(19(28)24-15)12-13-5-6-14(23-10-13)11-22-8-4-7-20/h5-6,10,22H,2-4,7-9,11-12,20H2,1H3,(H,24,28)(H2,21,25,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	28	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description Compounds diluted in DMSO were transferred to individual wells of a Matrix Technologies clear, V-bottom 384-well plate using ECHO acoustic liquid han...				US Patent US10919895 (2021) BindingDB Entry DOI: 10.7270/Q2KS6VNZ
					More data for this Ligand-Target Pair

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