Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Toll-like receptor 2' and Ligand = 'BDBM50358542'   

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 2 (Homo sapiens (Human))	BDBM50358542 (CHEMBL1923541) Show SMILES CCCCCCCCCCCCCC(=O)OC[C@H](CSC[C@H](N)C(=O)N[C@@H](CO)C(O)=O)OC(=O)CCCCCCCCCCCCC |r| Show InChI InChI=1S/C37H70N2O8S/c1-3-5-7-9-11-13-15-17-19-21-23-25-34(41)46-28-31(29-48-30-32(38)36(43)39-33(27-40)37(44)45)47-35(42)26-24-22-20-18-16-14-12-10-8-6-4-2/h31-33,40H,3-30,38H2,1-2H3,(H,39,43)(H,44,45)/t31-,32+,33+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.560	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human TLR2 expressed in HEK293 cells assessed as NF-kappaB induction measured soluble alkaline phosphatase after 12 hrs by spectr...				J Med Chem 54: 8148-60 (2011) Article DOI: 10.1021/jm201071e BindingDB Entry DOI: 10.7270/Q2KP82K8
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