Compile Data Set for Download or QSAR

Found 77 hits with Last Name = 'sakaniwa' and Initial = 'k'   

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 8 (Homo sapiens (Human))	BDBM50514792 (CHEMBL4519240) Show SMILES CSc1nnc(CCCO)n1-c1cc(C)c(C)c(C)c1 Show InChI InChI=1S/C15H21N3OS/c1-10-8-13(9-11(2)12(10)3)18-14(6-5-7-19)16-17-15(18)20-4/h8-9,19H,5-7H2,1-4H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK-Blue cells assessed as inhibition of R848-induced NF-kappaB activation measured after 24 hrs by quanti-blue...				J Med Chem 63: 4117-4132 (2020) Article DOI: 10.1021/acs.jmedchem.9b02128 BindingDB Entry DOI: 10.7270/Q2NV9NMG
					More data for this Ligand-Target Pair				3D Structure (crystal)
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514792 (CHEMBL4519240) Show SMILES CSc1nnc(CCCO)n1-c1cc(C)c(C)c(C)c1 Show InChI InChI=1S/C15H21N3OS/c1-10-8-13(9-11(2)12(10)3)18-14(6-5-7-19)16-17-15(18)20-4/h8-9,19H,5-7H2,1-4H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK-Blue cells assessed as inhibition of ssRNA06-induced NF-kappaB activation measured after 24 hrs by quanti-b...				J Med Chem 63: 4117-4132 (2020) Article DOI: 10.1021/acs.jmedchem.9b02128 BindingDB Entry DOI: 10.7270/Q2NV9NMG
					More data for this Ligand-Target Pair				3D Structure (crystal)
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514809 (CHEMBL4530243) Show SMILES CSc1nnc(CCCO)n1-c1cc(Cl)c(Cl)c(Cl)c1 Show InChI InChI=1S/C12H12Cl3N3OS/c1-20-12-17-16-10(3-2-4-19)18(12)7-5-8(13)11(15)9(14)6-7/h5-6,19H,2-4H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK-Blue cells assessed as inhibition of R848-induced NF-kappaB activation measured after 24 hrs by quanti-blue...				J Med Chem 63: 4117-4132 (2020) Article DOI: 10.1021/acs.jmedchem.9b02128 BindingDB Entry DOI: 10.7270/Q2NV9NMG
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514806 (CHEMBL4452260) Show SMILES CSc1nnc(CCCO)n1-c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C12H13Cl2N3OS/c1-19-12-16-15-11(3-2-6-18)17(12)8-4-5-9(13)10(14)7-8/h4-5,7,18H,2-3,6H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK-Blue cells assessed as inhibition of R848-induced NF-kappaB activation measured after 24 hrs by quanti-blue...				J Med Chem 63: 4117-4132 (2020) Article DOI: 10.1021/acs.jmedchem.9b02128 BindingDB Entry DOI: 10.7270/Q2NV9NMG
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514804 (CHEMBL4461378) Show SMILES CSc1nnc(CCCO)n1-c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C13H14F3N3OS/c1-21-12-18-17-11(6-3-7-20)19(12)10-5-2-4-9(8-10)13(14,15)16/h2,4-5,8,20H,3,6-7H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK-Blue cells assessed as inhibition of R848-induced NF-kappaB activation measured after 24 hrs by quanti-blue...				J Med Chem 63: 4117-4132 (2020) Article DOI: 10.1021/acs.jmedchem.9b02128 BindingDB Entry DOI: 10.7270/Q2NV9NMG
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514805 (CHEMBL4539893) Show SMILES CSc1nnc(CCCO)n1-c1cccc(C)c1 Show InChI InChI=1S/C13H17N3OS/c1-10-5-3-6-11(9-10)16-12(7-4-8-17)14-15-13(16)18-2/h3,5-6,9,17H,4,7-8H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	290	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK-Blue cells assessed as inhibition of R848-induced NF-kappaB activation measured after 24 hrs by quanti-blue...				J Med Chem 63: 4117-4132 (2020) Article DOI: 10.1021/acs.jmedchem.9b02128 BindingDB Entry DOI: 10.7270/Q2NV9NMG
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514797 (CHEMBL4451165) Show SMILES CSc1nnc(CCCO)n1-c1ccc(Cl)cc1Cl |(15.91,-8.56,;14.81,-9.65,;13.32,-9.24,;12.78,-7.8,;11.26,-7.87,;10.85,-9.35,;9.4,-9.87,;9.12,-11.39,;7.68,-11.91,;7.41,-13.43,;12.13,-10.19,;12.12,-11.75,;10.79,-12.51,;10.79,-14.06,;12.13,-14.83,;12.12,-16.37,;13.45,-14.06,;13.45,-12.52,;14.8,-11.73,)| Show InChI InChI=1S/C12H13Cl2N3OS/c1-19-12-16-15-11(3-2-6-18)17(12)10-5-4-8(13)7-9(10)14/h4-5,7,18H,2-3,6H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	290	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK-Blue cells assessed as inhibition of R848-induced NF-kappaB activation measured after 24 hrs by quanti-blue...				J Med Chem 63: 4117-4132 (2020) Article DOI: 10.1021/acs.jmedchem.9b02128 BindingDB Entry DOI: 10.7270/Q2NV9NMG
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514141 (CHEMBL4543348) Show SMILES [O-][N+](=O)c1c(I)cccc1Oc1ccc(cc1)-c1nnco1 Show InChI InChI=1S/C14H8IN3O4/c15-11-2-1-3-12(13(11)18(19)20)22-10-6-4-9(5-7-10)14-17-16-8-21-14/h1-8H	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
University of Colorado Boulder Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK293 cells assessed as reduction in R848-induced NFkappaB production incubated for 16 hrs by quanti-blue SEAP...				J Med Chem 62: 10221-10244 (2019) Article DOI: 10.1021/acs.jmedchem.9b01201 BindingDB Entry DOI: 10.7270/Q2BP064W
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514813 (CHEMBL4471285) Show SMILES CSc1nnc(CCCO)n1-c1cccc(Cl)c1 Show InChI InChI=1S/C12H14ClN3OS/c1-18-12-15-14-11(6-3-7-17)16(12)10-5-2-4-9(13)8-10/h2,4-5,8,17H,3,6-7H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	350	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK-Blue cells assessed as inhibition of R848-induced NF-kappaB activation measured after 24 hrs by quanti-blue...				J Med Chem 63: 4117-4132 (2020) Article DOI: 10.1021/acs.jmedchem.9b02128 BindingDB Entry DOI: 10.7270/Q2NV9NMG
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514796 (CHEMBL4535822) Show SMILES CCSc1nnc(CCCO)n1-c1ccc(Cl)cc1Cl |(16.41,-8.45,;14.94,-7.99,;13.8,-9.02,;12.34,-8.56,;11.85,-7.1,;10.31,-7.11,;9.84,-8.57,;8.38,-9.06,;7.23,-8.04,;7.54,-6.53,;6.39,-5.51,;11.1,-9.47,;11.11,-11.01,;12.44,-11.77,;12.45,-13.31,;11.12,-14.09,;11.13,-15.63,;9.79,-13.33,;9.78,-11.79,;8.44,-11.03,)| Show InChI InChI=1S/C13H15Cl2N3OS/c1-2-20-13-17-16-12(4-3-7-19)18(13)11-6-5-9(14)8-10(11)15/h5-6,8,19H,2-4,7H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	390	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK-Blue cells assessed as inhibition of R848-induced NF-kappaB activation measured after 24 hrs by quanti-blue...				J Med Chem 63: 4117-4132 (2020) Article DOI: 10.1021/acs.jmedchem.9b02128 BindingDB Entry DOI: 10.7270/Q2NV9NMG
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514807 (CHEMBL4590994) Show SMILES CSc1nnc(CCCO)n1-c1cccc2ccccc12 |(27.2,-29.84,;26.73,-28.38,;25.22,-28.05,;24.07,-29.09,;22.74,-28.32,;23.06,-26.81,;22.03,-25.66,;20.52,-25.98,;20.05,-27.45,;18.54,-27.77,;24.59,-26.65,;25.36,-25.31,;24.59,-23.98,;25.36,-22.65,;26.9,-22.65,;27.67,-23.98,;29.21,-23.98,;29.98,-25.31,;29.21,-26.65,;27.67,-26.65,;26.9,-25.31,)| Show InChI InChI=1S/C16H17N3OS/c1-21-16-18-17-15(10-5-11-20)19(16)14-9-4-7-12-6-2-3-8-13(12)14/h2-4,6-9,20H,5,10-11H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	390	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK-Blue cells assessed as inhibition of R848-induced NF-kappaB activation measured after 24 hrs by quanti-blue...				J Med Chem 63: 4117-4132 (2020) Article DOI: 10.1021/acs.jmedchem.9b02128 BindingDB Entry DOI: 10.7270/Q2NV9NMG
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514818 (CHEMBL4585768) Show SMILES CSc1nnc(CCCCCO)n1-c1ccc(Cl)cc1Cl |(15.05,-5.54,;13.88,-6.54,;12.42,-6.03,;11.98,-4.56,;10.44,-4.52,;9.93,-5.97,;8.46,-6.41,;7.34,-5.36,;5.86,-5.8,;4.74,-4.74,;3.27,-5.18,;2.15,-4.12,;11.16,-6.91,;11.12,-8.45,;12.44,-9.25,;12.4,-10.79,;11.05,-11.53,;11.01,-13.07,;9.73,-10.72,;9.77,-9.18,;8.45,-8.38,)| Show InChI InChI=1S/C14H17Cl2N3OS/c1-21-14-18-17-13(5-3-2-4-8-20)19(14)12-7-6-10(15)9-11(12)16/h6-7,9,20H,2-5,8H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	520	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK-Blue cells assessed as inhibition of R848-induced NF-kappaB activation measured after 24 hrs by quanti-blue...				J Med Chem 63: 4117-4132 (2020) Article DOI: 10.1021/acs.jmedchem.9b02128 BindingDB Entry DOI: 10.7270/Q2NV9NMG
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514811 (CHEMBL4564658) Show SMILES CSc1nnc(CO)n1-c1ccc(Cl)cc1Cl |(5.66,-11.55,;6.81,-12.57,;8.27,-12.09,;8.74,-10.63,;10.28,-10.62,;10.76,-12.08,;12.23,-12.55,;13.37,-11.52,;9.52,-12.99,;9.53,-14.53,;8.2,-15.31,;8.2,-16.85,;9.54,-17.61,;9.55,-19.15,;10.87,-16.84,;10.86,-15.3,;12.19,-14.52,)| Show InChI InChI=1S/C10H9Cl2N3OS/c1-17-10-14-13-9(5-16)15(10)8-3-2-6(11)4-7(8)12/h2-4,16H,5H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	550	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK-Blue cells assessed as inhibition of R848-induced NF-kappaB activation measured after 24 hrs by quanti-blue...				J Med Chem 63: 4117-4132 (2020) Article DOI: 10.1021/acs.jmedchem.9b02128 BindingDB Entry DOI: 10.7270/Q2NV9NMG
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514799 (CHEMBL4445770) Show SMILES CSc1nnc(CCO)n1-c1ccc(Cl)cc1Cl |(15.33,-12.38,;14.19,-13.42,;12.72,-12.95,;12.24,-11.48,;10.7,-11.49,;10.23,-12.96,;8.77,-13.44,;7.62,-12.42,;6.16,-12.9,;11.48,-13.86,;11.49,-15.4,;12.82,-16.16,;12.83,-17.7,;11.5,-18.48,;11.51,-20.02,;10.16,-17.71,;10.16,-16.17,;8.82,-15.41,)| Show InChI InChI=1S/C11H11Cl2N3OS/c1-18-11-15-14-10(4-5-17)16(11)9-3-2-7(12)6-8(9)13/h2-3,6,17H,4-5H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	590	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK-Blue cells assessed as inhibition of R848-induced NF-kappaB activation measured after 24 hrs by quanti-blue...				J Med Chem 63: 4117-4132 (2020) Article DOI: 10.1021/acs.jmedchem.9b02128 BindingDB Entry DOI: 10.7270/Q2NV9NMG
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514816 (CHEMBL4468868) Show SMILES CSc1nnc(CCCO)n1-c1ccc(Cl)c(Cl)c1Cl |(26.4,-24.74,;25.78,-26.15,;26.68,-27.4,;28.22,-27.4,;28.7,-28.86,;27.45,-29.77,;27.45,-31.31,;28.79,-32.08,;30.12,-31.31,;31.45,-32.08,;26.21,-28.86,;24.74,-29.34,;23.6,-28.31,;22.13,-28.78,;21.81,-30.29,;20.35,-30.77,;22.96,-31.32,;22.64,-32.83,;24.42,-30.84,;25.57,-31.87,)| Show InChI InChI=1S/C12H12Cl3N3OS/c1-20-12-17-16-9(3-2-6-19)18(12)8-5-4-7(13)10(14)11(8)15/h4-5,19H,2-3,6H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK-Blue cells assessed as inhibition of R848-induced NF-kappaB activation measured after 24 hrs by quanti-blue...				J Med Chem 63: 4117-4132 (2020) Article DOI: 10.1021/acs.jmedchem.9b02128 BindingDB Entry DOI: 10.7270/Q2NV9NMG
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514141 (CHEMBL4543348) Show SMILES [O-][N+](=O)c1c(I)cccc1Oc1ccc(cc1)-c1nnco1 Show InChI InChI=1S/C14H8IN3O4/c15-11-2-1-3-12(13(11)18(19)20)22-10-6-4-9(5-7-10)14-17-16-8-21-14/h1-8H	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	620	n/a	n/a	n/a	n/a	n/a	n/a
University of Colorado Boulder Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK293 cells assessed as reduction in ssRNA-induced NFkappaB production incubated for 16 hrs by quanti-blue SEA...				J Med Chem 62: 10221-10244 (2019) Article DOI: 10.1021/acs.jmedchem.9b01201 BindingDB Entry DOI: 10.7270/Q2BP064W
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514800 (CHEMBL4449343) Show SMILES CCCc1nnc(SC)n1-c1ccc(Cl)cc1Cl |(5.01,-12.3,;6.49,-11.89,;6.89,-10.4,;8.38,-9.99,;8.92,-8.56,;10.43,-8.62,;10.85,-10.1,;12.29,-10.62,;13.46,-9.64,;9.57,-10.95,;9.57,-12.49,;8.24,-13.26,;8.23,-14.8,;9.57,-15.57,;9.57,-17.1,;10.89,-14.8,;10.9,-13.26,;12.24,-12.48,)| Show InChI InChI=1S/C12H13Cl2N3S/c1-3-4-11-15-16-12(18-2)17(11)10-6-5-8(13)7-9(10)14/h5-7H,3-4H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	630	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK-Blue cells assessed as inhibition of R848-induced NF-kappaB activation measured after 24 hrs by quanti-blue...				J Med Chem 63: 4117-4132 (2020) Article DOI: 10.1021/acs.jmedchem.9b02128 BindingDB Entry DOI: 10.7270/Q2NV9NMG
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514130 (CHEMBL4467356) Show SMILES [O-][N+](=O)c1c(Cl)cccc1Oc1ccc(cc1)-c1nnco1 Show InChI InChI=1S/C14H8ClN3O4/c15-11-2-1-3-12(13(11)18(19)20)22-10-6-4-9(5-7-10)14-17-16-8-21-14/h1-8H	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	770	n/a	n/a	n/a	n/a	n/a	n/a
University of Colorado Boulder Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK293 cells assessed as reduction in R848-induced NFkappaB production incubated for 16 hrs by quanti-blue SEAP...				J Med Chem 62: 10221-10244 (2019) Article DOI: 10.1021/acs.jmedchem.9b01201 BindingDB Entry DOI: 10.7270/Q2BP064W
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514819 (CHEMBL4446241) Show SMILES CSc1nnc(CCCO)n1-c1cccc(Cl)c1Cl |(14.37,-7.35,;13.19,-8.34,;11.75,-7.81,;11.32,-6.33,;9.79,-6.27,;9.26,-7.72,;7.78,-8.14,;6.67,-7.07,;7.04,-5.57,;5.94,-4.5,;10.47,-8.67,;10.41,-10.21,;11.72,-11.02,;11.66,-12.56,;10.3,-13.28,;9,-12.47,;7.64,-13.19,;9.05,-10.93,;7.75,-10.11,)| Show InChI InChI=1S/C12H13Cl2N3OS/c1-19-12-16-15-10(6-3-7-18)17(12)9-5-2-4-8(13)11(9)14/h2,4-5,18H,3,6-7H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK-Blue cells assessed as inhibition of R848-induced NF-kappaB activation measured after 24 hrs by quanti-blue...				J Med Chem 63: 4117-4132 (2020) Article DOI: 10.1021/acs.jmedchem.9b02128 BindingDB Entry DOI: 10.7270/Q2NV9NMG
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514129 (CHEMBL4593624) Show SMILES Brc1cccc(Oc2ccc(cc2)-c2nnco2)c1C#N Show InChI InChI=1S/C15H8BrN3O2/c16-13-2-1-3-14(12(13)8-17)21-11-6-4-10(5-7-11)15-19-18-9-20-15/h1-7,9H	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	880	n/a	n/a	n/a	n/a	n/a	n/a
University of Colorado Boulder Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK293 cells assessed as reduction in R848-induced NFkappaB production incubated for 16 hrs by quanti-blue SEAP...				J Med Chem 62: 10221-10244 (2019) Article DOI: 10.1021/acs.jmedchem.9b01201 BindingDB Entry DOI: 10.7270/Q2BP064W
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514821 (CHEMBL4451720) Show SMILES CSc1nnc(CCCO)n1-c1ccccc1Cl |(14.39,-8.88,;13.29,-9.96,;11.8,-9.55,;11.27,-8.1,;9.73,-8.17,;9.32,-9.66,;7.87,-10.19,;6.68,-9.22,;6.94,-7.7,;5.75,-6.72,;10.6,-10.5,;10.67,-12.04,;12.03,-12.75,;12.1,-14.29,;10.8,-15.12,;9.44,-14.41,;9.37,-12.87,;8,-12.16,)| Show InChI InChI=1S/C12H14ClN3OS/c1-18-12-15-14-11(7-4-8-17)16(12)10-6-3-2-5-9(10)13/h2-3,5-6,17H,4,7-8H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	980	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK-Blue cells assessed as inhibition of R848-induced NF-kappaB activation measured after 24 hrs by quanti-blue...				J Med Chem 63: 4117-4132 (2020) Article DOI: 10.1021/acs.jmedchem.9b02128 BindingDB Entry DOI: 10.7270/Q2NV9NMG
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM50514126 (CHEMBL4553003) Show SMILES Fc1cccc(Br)c1C(=O)Nc1ccc(Oc2cc(cc(c2)C(F)(F)F)C(F)(F)F)cc1 Show InChI InChI=1S/C21H11BrF7NO2/c22-16-2-1-3-17(23)18(16)19(31)30-13-4-6-14(7-5-13)32-15-9-11(20(24,25)26)8-12(10-15)21(27,28)29/h1-10H,(H,30,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Colorado Boulder Curated by ChEMBL					Assay Description Inhibition of human TLR7 expressed in HEK293 cells assessed as reduction in R848-induced NFkappaB production incubated for 16 hrs by quanti-blue SEAP...				J Med Chem 62: 10221-10244 (2019) Article DOI: 10.1021/acs.jmedchem.9b01201 BindingDB Entry DOI: 10.7270/Q2BP064W
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514123 (CHEMBL4460125) Show SMILES Fc1cccc(I)c1C(=O)Nc1ccc(Oc2cc(cc(c2)C(F)(F)F)C(F)(F)F)cc1 Show InChI InChI=1S/C21H11F7INO2/c22-16-2-1-3-17(29)18(16)19(31)30-13-4-6-14(7-5-13)32-15-9-11(20(23,24)25)8-12(10-15)21(26,27)28/h1-10H,(H,30,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.04E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Colorado Boulder Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK293 cells assessed as reduction in R848-induced NFkappaB production incubated for 16 hrs by quanti-blue SEAP...				J Med Chem 62: 10221-10244 (2019) Article DOI: 10.1021/acs.jmedchem.9b01201 BindingDB Entry DOI: 10.7270/Q2BP064W
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514820 (CHEMBL4437576) Show SMILES CSc1nnc(CCCCO)n1-c1ccc(Cl)cc1Cl |(13.55,-12.85,;12.41,-13.9,;10.95,-13.44,;10.45,-11.98,;8.91,-11.99,;8.45,-13.46,;6.99,-13.95,;5.84,-12.93,;6.14,-11.42,;4.99,-10.41,;5.29,-8.9,;9.71,-14.35,;9.72,-15.89,;11.07,-16.65,;11.08,-18.19,;9.76,-18.97,;9.77,-20.51,;8.41,-18.22,;8.4,-16.68,;7.06,-15.92,)| Show InChI InChI=1S/C13H15Cl2N3OS/c1-20-13-17-16-12(4-2-3-7-19)18(13)11-6-5-9(14)8-10(11)15/h5-6,8,19H,2-4,7H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.06E+3	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK-Blue cells assessed as inhibition of R848-induced NF-kappaB activation measured after 24 hrs by quanti-blue...				J Med Chem 63: 4117-4132 (2020) Article DOI: 10.1021/acs.jmedchem.9b02128 BindingDB Entry DOI: 10.7270/Q2NV9NMG
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514137 (CHEMBL4455524) Show SMILES Fc1ccc(Cl)cc1C(=O)Nc1ccc(Oc2cc(cc(c2)C(F)(F)F)C(F)(F)F)cc1 Show InChI InChI=1S/C21H11ClF7NO2/c22-13-1-6-18(23)17(10-13)19(31)30-14-2-4-15(5-3-14)32-16-8-11(20(24,25)26)7-12(9-16)21(27,28)29/h1-10H,(H,30,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.11E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Colorado Boulder Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK293 cells assessed as reduction in R848-induced NFkappaB production incubated for 16 hrs by quanti-blue SEAP...				J Med Chem 62: 10221-10244 (2019) Article DOI: 10.1021/acs.jmedchem.9b01201 BindingDB Entry DOI: 10.7270/Q2BP064W
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514801 (CHEMBL4473196) Show SMILES COCCCc1nnc(SC)n1-c1ccc(Cl)cc1Cl |(15.11,-6.31,;13.63,-5.89,;12.53,-6.97,;11.05,-6.55,;9.94,-7.62,;8.46,-7.21,;7.93,-5.76,;6.39,-5.82,;5.97,-7.3,;4.53,-7.84,;3.34,-6.85,;7.25,-8.16,;7.31,-9.7,;6.01,-10.52,;6.07,-12.06,;7.43,-12.78,;7.5,-14.32,;8.74,-11.95,;8.68,-10.42,;9.98,-9.59,)| Show InChI InChI=1S/C13H15Cl2N3OS/c1-19-7-3-4-12-16-17-13(20-2)18(12)11-6-5-9(14)8-10(11)15/h5-6,8H,3-4,7H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.18E+3	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK-Blue cells assessed as inhibition of R848-induced NF-kappaB activation measured after 24 hrs by quanti-blue...				J Med Chem 63: 4117-4132 (2020) Article DOI: 10.1021/acs.jmedchem.9b02128 BindingDB Entry DOI: 10.7270/Q2NV9NMG
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514145 (CHEMBL4556342) Show SMILES Clc1cccc(Oc2ccc(cc2)-c2nnco2)c1C#N Show InChI InChI=1S/C15H8ClN3O2/c16-13-2-1-3-14(12(13)8-17)21-11-6-4-10(5-7-11)15-19-18-9-20-15/h1-7,9H	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Colorado Boulder Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK293 cells assessed as reduction in R848-induced NFkappaB production incubated for 16 hrs by quanti-blue SEAP...				J Med Chem 62: 10221-10244 (2019) Article DOI: 10.1021/acs.jmedchem.9b01201 BindingDB Entry DOI: 10.7270/Q2BP064W
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM50514128 (CHEMBL4460503) Show SMILES Fc1cccc(Cl)c1C(=O)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F Show InChI InChI=1S/C15H7ClF7NO/c16-10-2-1-3-11(17)12(10)13(25)24-9-5-7(14(18,19)20)4-8(6-9)15(21,22)23/h1-6H,(H,24,25)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Colorado Boulder Curated by ChEMBL					Assay Description Inhibition of human TLR7 expressed in HEK293 cells assessed as reduction in resiquimod-induced NFkappaB production at 1.5 to 5 uM incubated for 16 hr...				J Med Chem 62: 10221-10244 (2019) Article DOI: 10.1021/acs.jmedchem.9b01201 BindingDB Entry DOI: 10.7270/Q2BP064W
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514153 (CHEMBL4469304) Show SMILES Fc1cc(Oc2ccc(NC(=O)c3c(F)cccc3Cl)cc2)cc(c1)C(F)(F)F Show InChI InChI=1S/C20H11ClF5NO2/c21-16-2-1-3-17(23)18(16)19(28)27-13-4-6-14(7-5-13)29-15-9-11(20(24,25)26)8-12(22)10-15/h1-10H,(H,27,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.59E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Colorado Boulder Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK293 cells assessed as reduction in R848-induced NFkappaB production incubated for 16 hrs by quanti-blue SEAP...				J Med Chem 62: 10221-10244 (2019) Article DOI: 10.1021/acs.jmedchem.9b01201 BindingDB Entry DOI: 10.7270/Q2BP064W
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514794 (CHEMBL4519304) Show SMILES CSc1nnc(CCCO)n1-c1ccc(Cl)cc1 Show InChI InChI=1S/C12H14ClN3OS/c1-18-12-15-14-11(3-2-8-17)16(12)10-6-4-9(13)5-7-10/h4-7,17H,2-3,8H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.61E+3	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK-Blue cells assessed as inhibition of R848-induced NF-kappaB activation measured after 24 hrs by quanti-blue...				J Med Chem 63: 4117-4132 (2020) Article DOI: 10.1021/acs.jmedchem.9b02128 BindingDB Entry DOI: 10.7270/Q2NV9NMG
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514148 (CHEMBL4475557) Show SMILES Fc1cccc(Cl)c1C(=O)Nc1ccc(Oc2cc(cc(c2)C(F)(F)F)C(F)(F)F)cc1 Show InChI InChI=1S/C21H11ClF7NO2/c22-16-2-1-3-17(23)18(16)19(31)30-13-4-6-14(7-5-13)32-15-9-11(20(24,25)26)8-12(10-15)21(27,28)29/h1-10H,(H,30,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.64E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Colorado Boulder Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK293 cells assessed as reduction in R848-induced NFkappaB production incubated for 16 hrs by quanti-blue SEAP...				J Med Chem 62: 10221-10244 (2019) Article DOI: 10.1021/acs.jmedchem.9b01201 BindingDB Entry DOI: 10.7270/Q2BP064W
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514133 (CHEMBL4517952) Show SMILES Fc1cccc(Cl)c1C(=O)Nc1ccc(Oc2cc(Cl)cc(c2)C(F)(F)F)cc1 Show InChI InChI=1S/C20H11Cl2F4NO2/c21-12-8-11(20(24,25)26)9-15(10-12)29-14-6-4-13(5-7-14)27-19(28)18-16(22)2-1-3-17(18)23/h1-10H,(H,27,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.04E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Colorado Boulder Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK293 cells assessed as reduction in R848-induced NFkappaB production incubated for 16 hrs by quanti-blue SEAP...				J Med Chem 62: 10221-10244 (2019) Article DOI: 10.1021/acs.jmedchem.9b01201 BindingDB Entry DOI: 10.7270/Q2BP064W
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514812 (CHEMBL4564959) Show SMILES CSc1nnc(CCCOC(C)=O)n1-c1ccc(Cl)cc1Cl |(14.27,-9.57,;13.14,-10.61,;11.67,-10.16,;11.17,-8.7,;9.63,-8.73,;9.17,-10.2,;7.72,-10.69,;6.56,-9.68,;6.85,-8.17,;5.7,-7.16,;5.99,-5.65,;4.83,-4.63,;7.45,-5.15,;10.43,-11.08,;10.46,-12.62,;11.8,-13.37,;11.82,-14.91,;10.5,-15.7,;10.53,-17.24,;9.16,-14.95,;9.13,-13.41,;7.79,-12.66,)| Show InChI InChI=1S/C14H15Cl2N3O2S/c1-9(20)21-7-3-4-13-17-18-14(22-2)19(13)12-6-5-10(15)8-11(12)16/h5-6,8H,3-4,7H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.08E+3	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK-Blue cells assessed as inhibition of R848-induced NF-kappaB activation measured after 24 hrs by quanti-blue...				J Med Chem 63: 4117-4132 (2020) Article DOI: 10.1021/acs.jmedchem.9b02128 BindingDB Entry DOI: 10.7270/Q2NV9NMG
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514132 (CHEMBL4460468) Show SMILES Fc1cccc(Cl)c1C(=O)Nc1ccc(Oc2cc(Br)cc(c2)C(F)(F)F)cc1 Show InChI InChI=1S/C20H11BrClF4NO2/c21-12-8-11(20(24,25)26)9-15(10-12)29-14-6-4-13(5-7-14)27-19(28)18-16(22)2-1-3-17(18)23/h1-10H,(H,27,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.32E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Colorado Boulder Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK293 cells assessed as reduction in R848-induced NFkappaB production incubated for 16 hrs by quanti-blue SEAP...				J Med Chem 62: 10221-10244 (2019) Article DOI: 10.1021/acs.jmedchem.9b01201 BindingDB Entry DOI: 10.7270/Q2BP064W
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514134 (CHEMBL4435177) Show SMILES Fc1cccc(Cl)c1C(=O)Nc1ccc(Oc2cccc(c2)C(F)(F)F)cc1 Show InChI InChI=1S/C20H12ClF4NO2/c21-16-5-2-6-17(22)18(16)19(27)26-13-7-9-14(10-8-13)28-15-4-1-3-12(11-15)20(23,24)25/h1-11H,(H,26,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.41E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Colorado Boulder Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK293 cells assessed as reduction in R848-induced NFkappaB production incubated for 16 hrs by quanti-blue SEAP...				J Med Chem 62: 10221-10244 (2019) Article DOI: 10.1021/acs.jmedchem.9b01201 BindingDB Entry DOI: 10.7270/Q2BP064W
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514139 (CHEMBL4437017) Show SMILES Clc1cccc(COc2ccc(cc2)-c2nnco2)c1C#N Show InChI InChI=1S/C16H10ClN3O2/c17-15-3-1-2-12(14(15)8-18)9-21-13-6-4-11(5-7-13)16-20-19-10-22-16/h1-7,10H,9H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.52E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Colorado Boulder Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK293 cells assessed as reduction in R848-induced NFkappaB production incubated for 16 hrs by quanti-blue SEAP...				J Med Chem 62: 10221-10244 (2019) Article DOI: 10.1021/acs.jmedchem.9b01201 BindingDB Entry DOI: 10.7270/Q2BP064W
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514144 (CHEMBL4483769) Show SMILES Oc1cc(Oc2cc(cc(c2)C(F)(F)F)C(F)(F)F)ccc1NC(=O)c1c(F)cccc1I Show InChI InChI=1S/C21H11F7INO3/c22-14-2-1-3-15(29)18(14)19(32)30-16-5-4-12(9-17(16)31)33-13-7-10(20(23,24)25)6-11(8-13)21(26,27)28/h1-9,31H,(H,30,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.63E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Colorado Boulder Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK293 cells assessed as reduction in R848-induced NFkappaB production incubated for 16 hrs by quanti-blue SEAP...				J Med Chem 62: 10221-10244 (2019) Article DOI: 10.1021/acs.jmedchem.9b01201 BindingDB Entry DOI: 10.7270/Q2BP064W
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM50514134 (CHEMBL4435177) Show SMILES Fc1cccc(Cl)c1C(=O)Nc1ccc(Oc2cccc(c2)C(F)(F)F)cc1 Show InChI InChI=1S/C20H12ClF4NO2/c21-16-5-2-6-17(22)18(16)19(27)26-13-7-9-14(10-8-13)28-15-4-1-3-12(11-15)20(23,24)25/h1-11H,(H,26,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.65E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Colorado Boulder Curated by ChEMBL					Assay Description Inhibition of human TLR7 expressed in HEK293 cells assessed as reduction in R848-induced NFkappaB production incubated for 16 hrs by quanti-blue SEAP...				J Med Chem 62: 10221-10244 (2019) Article DOI: 10.1021/acs.jmedchem.9b01201 BindingDB Entry DOI: 10.7270/Q2BP064W
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514814 (CHEMBL4437700) Show SMILES CSc1nnc(CCCO)n1-c1c(Cl)cc(Cl)cc1Cl |(25.82,-26.98,;25.2,-28.39,;26.1,-29.63,;27.64,-29.63,;28.12,-31.1,;26.87,-32,;26.87,-33.54,;28.21,-34.31,;29.54,-33.54,;30.87,-34.31,;25.63,-31.1,;24.16,-31.57,;23.02,-30.54,;23.34,-29.04,;21.55,-31.02,;21.23,-32.53,;19.77,-33,;22.38,-33.56,;23.84,-33.08,;24.99,-34.11,)| Show InChI InChI=1S/C12H12Cl3N3OS/c1-20-12-17-16-10(3-2-4-19)18(12)11-8(14)5-7(13)6-9(11)15/h5-6,19H,2-4H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.81E+3	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK-Blue cells assessed as inhibition of R848-induced NF-kappaB activation measured after 24 hrs by quanti-blue...				J Med Chem 63: 4117-4132 (2020) Article DOI: 10.1021/acs.jmedchem.9b02128 BindingDB Entry DOI: 10.7270/Q2NV9NMG
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514151 (CHEMBL4456777) Show SMILES Fc1cccc(Cl)c1C(=O)Nc1ccc(Oc2cncc(c2)C(F)(F)F)cc1 Show InChI InChI=1S/C19H11ClF4N2O2/c20-15-2-1-3-16(21)17(15)18(27)26-12-4-6-13(7-5-12)28-14-8-11(9-25-10-14)19(22,23)24/h1-10H,(H,26,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.87E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Colorado Boulder Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK293 cells assessed as reduction in R848-induced NFkappaB production incubated for 16 hrs by quanti-blue SEAP...				J Med Chem 62: 10221-10244 (2019) Article DOI: 10.1021/acs.jmedchem.9b01201 BindingDB Entry DOI: 10.7270/Q2BP064W
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM50514148 (CHEMBL4475557) Show SMILES Fc1cccc(Cl)c1C(=O)Nc1ccc(Oc2cc(cc(c2)C(F)(F)F)C(F)(F)F)cc1 Show InChI InChI=1S/C21H11ClF7NO2/c22-16-2-1-3-17(23)18(16)19(31)30-13-4-6-14(7-5-13)32-15-9-11(20(24,25)26)8-12(10-15)21(27,28)29/h1-10H,(H,30,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.88E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Colorado Boulder Curated by ChEMBL					Assay Description Inhibition of human TLR7 expressed in HEK293 cells assessed as reduction in R848-induced NFkappaB production incubated for 16 hrs by quanti-blue SEAP...				J Med Chem 62: 10221-10244 (2019) Article DOI: 10.1021/acs.jmedchem.9b01201 BindingDB Entry DOI: 10.7270/Q2BP064W
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM50514127 (CHEMBL4468417) Show SMILES CN(C(=O)c1c(F)cccc1Cl)c1ccc(Oc2cc(cc(c2)C(F)(F)F)C(F)(F)F)cc1 Show InChI InChI=1S/C22H13ClF7NO2/c1-31(20(32)19-17(23)3-2-4-18(19)24)14-5-7-15(8-6-14)33-16-10-12(21(25,26)27)9-13(11-16)22(28,29)30/h2-11H,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Colorado Boulder Curated by ChEMBL					Assay Description Inhibition of human TLR7 expressed in HEK293 cells assessed as reduction in resiquimod-induced NFkappaB production at 1.5 to 5 uM incubated for 16 hr...				J Med Chem 62: 10221-10244 (2019) Article DOI: 10.1021/acs.jmedchem.9b01201 BindingDB Entry DOI: 10.7270/Q2BP064W
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514138 (CHEMBL4572948) Show SMILES Fc1ccccc1C(=O)Nc1ccc(Oc2cc(cc(c2)C(F)(F)F)C(F)(F)F)cc1 Show InChI InChI=1S/C21H12F7NO2/c22-18-4-2-1-3-17(18)19(30)29-14-5-7-15(8-6-14)31-16-10-12(20(23,24)25)9-13(11-16)21(26,27)28/h1-11H,(H,29,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Colorado Boulder Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK293 cells assessed as reduction in R848-induced NFkappaB production incubated for 16 hrs by quanti-blue SEAP...				J Med Chem 62: 10221-10244 (2019) Article DOI: 10.1021/acs.jmedchem.9b01201 BindingDB Entry DOI: 10.7270/Q2BP064W
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514135 (CHEMBL4542663) Show SMILES FC(F)(F)c1cc(Oc2ccc(NC(=O)c3sccc3Cl)cc2)cc(c1)C(F)(F)F Show InChI InChI=1S/C19H10ClF6NO2S/c20-15-5-6-30-16(15)17(28)27-12-1-3-13(4-2-12)29-14-8-10(18(21,22)23)7-11(9-14)19(24,25)26/h1-9H,(H,27,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Colorado Boulder Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK293 cells assessed as reduction in R848-induced NFkappaB production incubated for 16 hrs by quanti-blue SEAP...				J Med Chem 62: 10221-10244 (2019) Article DOI: 10.1021/acs.jmedchem.9b01201 BindingDB Entry DOI: 10.7270/Q2BP064W
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514802 (CHEMBL4584095) Show SMILES COc1ccc(cc1)-n1c(CCCO)nnc1SC Show InChI InChI=1S/C13H17N3O2S/c1-18-11-7-5-10(6-8-11)16-12(4-3-9-17)14-15-13(16)19-2/h5-8,17H,3-4,9H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.86E+3	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK-Blue cells assessed as inhibition of R848-induced NF-kappaB activation measured after 24 hrs by quanti-blue...				J Med Chem 63: 4117-4132 (2020) Article DOI: 10.1021/acs.jmedchem.9b02128 BindingDB Entry DOI: 10.7270/Q2NV9NMG
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514140 (CHEMBL4546506) Show SMILES Oc1cc(Oc2cc(cc(c2)C(F)(F)F)C(F)(F)F)ccc1NC(=O)c1c(F)cccc1Cl Show InChI InChI=1S/C21H11ClF7NO3/c22-14-2-1-3-15(23)18(14)19(32)30-16-5-4-12(9-17(16)31)33-13-7-10(20(24,25)26)6-11(8-13)21(27,28)29/h1-9,31H,(H,30,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.02E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Colorado Boulder Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK293 cells assessed as reduction in R848-induced NFkappaB production incubated for 16 hrs by quanti-blue SEAP...				J Med Chem 62: 10221-10244 (2019) Article DOI: 10.1021/acs.jmedchem.9b01201 BindingDB Entry DOI: 10.7270/Q2BP064W
					More data for this Ligand-Target Pair
Toll-like receptor 7 (Homo sapiens (Human))	BDBM50514144 (CHEMBL4483769) Show SMILES Oc1cc(Oc2cc(cc(c2)C(F)(F)F)C(F)(F)F)ccc1NC(=O)c1c(F)cccc1I Show InChI InChI=1S/C21H11F7INO3/c22-14-2-1-3-15(29)18(14)19(32)30-16-5-4-12(9-17(16)31)33-13-7-10(20(23,24)25)6-11(8-13)21(26,27)28/h1-9,31H,(H,30,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.73E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Colorado Boulder Curated by ChEMBL					Assay Description Inhibition of human TLR7 expressed in HEK293 cells assessed as reduction in R848-induced NFkappaB production incubated for 16 hrs by quanti-blue SEAP...				J Med Chem 62: 10221-10244 (2019) Article DOI: 10.1021/acs.jmedchem.9b01201 BindingDB Entry DOI: 10.7270/Q2BP064W
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514803 (CHEMBL4547071) Show SMILES CSc1nnc(CCCO)n1-c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C13H14F3N3OS/c1-21-12-18-17-11(3-2-8-20)19(12)10-6-4-9(5-7-10)13(14,15)16/h4-7,20H,2-3,8H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.84E+3	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK-Blue cells assessed as inhibition of R848-induced NF-kappaB activation measured after 24 hrs by quanti-blue...				J Med Chem 63: 4117-4132 (2020) Article DOI: 10.1021/acs.jmedchem.9b02128 BindingDB Entry DOI: 10.7270/Q2NV9NMG
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514124 (CHEMBL4443220) Show SMILES Fc1cccc(Cl)c1C(=O)Nc1ccc(Oc2cc(I)cc(c2)C(F)(F)F)cc1 Show InChI InChI=1S/C20H11ClF4INO2/c21-16-2-1-3-17(22)18(16)19(28)27-13-4-6-14(7-5-13)29-15-9-11(20(23,24)25)8-12(26)10-15/h1-10H,(H,27,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Colorado Boulder Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK293 cells assessed as reduction in R848-induced NFkappaB production incubated for 16 hrs by quanti-blue SEAP...				J Med Chem 62: 10221-10244 (2019) Article DOI: 10.1021/acs.jmedchem.9b01201 BindingDB Entry DOI: 10.7270/Q2BP064W
					More data for this Ligand-Target Pair
Toll-like receptor 8 (Homo sapiens (Human))	BDBM50514150 (CHEMBL4443600) Show SMILES Nc1c(Cl)cccc1Oc1ccc(cc1)-c1nnco1 Show InChI InChI=1S/C14H10ClN3O2/c15-11-2-1-3-12(13(11)16)20-10-6-4-9(5-7-10)14-18-17-8-19-14/h1-8H,16H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.29E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Colorado Boulder Curated by ChEMBL					Assay Description Inhibition of human TLR8 expressed in HEK293 cells assessed as reduction in R848-induced NFkappaB production incubated for 16 hrs by quanti-blue SEAP...				J Med Chem 62: 10221-10244 (2019) Article DOI: 10.1021/acs.jmedchem.9b01201 BindingDB Entry DOI: 10.7270/Q2BP064W
					More data for this Ligand-Target Pair

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