BDBM286470 US9518064, Example 89

SMILES: COc1nn2cc(nc2s1)-c1cc2c(OCc3cccc(c3)-c3ccc(OC4CCCCO4)cn3)cc(OC)cc2o1

InChI Key: InChIKey=NOZXJBVKNVKAEF-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 = 286470   

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
Proteinase-activated receptor 4 (PAR4) (Homo sapiens (Human))	BDBM286470 (US9518064, Example 89) Show SMILES COc1nn2cc(nc2s1)-c1cc2c(OCc3cccc(c3)-c3ccc(OC4CCCCO4)cn3)cc(OC)cc2o1 Show InChI InChI=1S/C31H28N4O6S/c1-36-22-13-26(23-15-28(41-27(23)14-22)25-17-35-30(33-25)42-31(34-35)37-2)39-18-19-6-5-7-20(12-19)24-10-9-21(16-32-24)40-29-8-3-4-11-38-29/h5-7,9-10,12-17,29H,3-4,8,11,18H2,1-2H3	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.790	n/a	n/a	n/a	n/a	n/a	25
Bristol-Myers Squibb Company; Universite De Montreal US Patent					Assay Description The activity of the PAR4 antagonists of the present invention were tested in PAR4 expressing cells by monitoring H-Ala-Phe(4-F)-Pro-Gly-Trp-Leu-Val-L...				US Patent US9518064 (2016) BindingDB Entry DOI: 10.7270/Q2TT4SZX
					More data for this Ligand-Target Pair