BDBM199434 US9676818, 65

SMILES: CCCCCCCCCCC[C@@H](O)CC(=O)OCCSC[C@H](NC(C)=O)C(=O)N[C@@H](CO)C(=O)OC

InChI Key: InChIKey=XRLRYNLTJUIFMA-FSSWDIPSSA-N

Data: 1 EC50

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 = 199434   

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 2 (TLR2) (Homo sapiens (Human))	BDBM199434 (US9676818, 65) Show SMILES CCCCCCCCCCC[C@@H](O)CC(=O)OCCSC[C@H](NC(C)=O)C(=O)N[C@@H](CO)C(=O)OC |r| Show InChI InChI=1S/C25H46N2O8S/c1-4-5-6-7-8-9-10-11-12-13-20(30)16-23(31)35-14-15-36-18-22(26-19(2)29)24(32)27-21(17-28)25(33)34-3/h20-22,28,30H,4-18H2,1-3H3,(H,26,29)(H,27,32)/t20-,21+,22+/m1/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	1.13E+3	n/a	n/a	n/a	n/a
University of Kansas US Patent					Assay Description The induction of NF-κB in a TLR2-specific reporter gene assay was quantified using HEK-BLUE™ cells as previously described (Wu, W. et al., ...				US Patent US9676818 (2017) BindingDB Entry DOI: 10.7270/Q2TB1539
					More data for this Ligand-Target Pair