BDBM50514795 CHEMBL4475464

SMILES: CC(C)Sc1nnc(CCCO)n1-c1ccc(Cl)cc1Cl

InChI Key: InChIKey=RSAWPQBFFJOMQC-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50514795   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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))	BDBM50514795 (CHEMBL4475464) Show SMILES CC(C)Sc1nnc(CCCO)n1-c1ccc(Cl)cc1Cl |(27.07,-36.52,;27.97,-35.27,;29.51,-35.44,;27.35,-33.87,;28.25,-32.62,;29.79,-32.62,;30.27,-31.16,;29.02,-30.25,;29.02,-28.71,;30.36,-27.94,;31.69,-28.71,;33.02,-27.94,;27.78,-31.16,;26.31,-30.68,;25.17,-31.71,;23.7,-31.24,;23.38,-29.73,;21.92,-29.25,;24.53,-28.7,;25.99,-29.17,;27.14,-28.14,)| Show InChI InChI=1S/C14H17Cl2N3OS/c1-9(2)21-14-18-17-13(4-3-7-20)19(14)12-6-5-10(15)8-11(12)16/h5-6,8-9,20H,3-4,7H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.01E+4	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
					More data for this Ligand-Target Pair