BDBM257330 US9493440, 174

SMILES: Cc1nonc1N1CCN(CC1)c1cc(ncn1)-c1n[nH]c2cc(F)c(OC3(C)CC3)cc12

InChI Key: InChIKey=YOJSWOXIAIWRDH-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 = 257330   

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
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S) (Homo sapiens (Human))	BDBM257330 (US9493440, 174) Show SMILES Cc1nonc1N1CCN(CC1)c1cc(ncn1)-c1n[nH]c2cc(F)c(OC3(C)CC3)cc12 Show InChI InChI=1S/C22H23FN8O2/c1-13-21(29-33-28-13)31-7-5-30(6-8-31)19-11-17(24-12-25-19)20-14-9-18(32-22(2)3-4-22)15(23)10-16(14)26-27-20/h9-12H,3-8H2,1-2H3,(H,26,27)	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.600	n/a	n/a	n/a	n/a	8.5	25
Merck Sharp & Dohme Corp. US Patent					Assay Description a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...				US Patent US9493440 (2016) BindingDB Entry DOI: 10.7270/Q2668C4X
					More data for this Ligand-Target Pair