BDBM223550 US9321748, 10

SMILES: CC(C)n1cc(nn1)-c1cc(cnc1N)-c1ccc2N(C)CCc2c1

InChI Key: InChIKey=OTCKNJDQPALGIV-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 223550   

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) (Homo sapiens (Human))	BDBM223550 (US9321748, 10) Show SMILES CC(C)n1cc(nn1)-c1cc(cnc1N)-c1ccc2N(C)CCc2c1 Show InChI InChI=1S/C19H22N6/c1-12(2)25-11-17(22-23-25)16-9-15(10-21-19(16)20)13-4-5-18-14(8-13)6-7-24(18)3/h4-5,8-12H,6-7H2,1-3H3,(H2,20,21)	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	620	n/a	n/a	n/a	n/a	8.5	30
H. Lundbeck A/S; Vernalis (R&D) Ltd. US Patent					Assay Description The kinase reaction buffer consists of 50 mM Tris pH 8.5, 0.01% BRIJ-35, 10 mM MgCl2, 1 mM EGTA, and 2 mM DTT. In the assay, 1 nM LRRK2 WT or 250 pM ...				US Patent US9321748 (2016) BindingDB Entry DOI: 10.7270/Q22R3QHC
					More data for this Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S) (Homo sapiens (Human))	BDBM223550 (US9321748, 10) Show SMILES CC(C)n1cc(nn1)-c1cc(cnc1N)-c1ccc2N(C)CCc2c1 Show InChI InChI=1S/C19H22N6/c1-12(2)25-11-17(22-23-25)16-9-15(10-21-19(16)20)13-4-5-18-14(8-13)6-7-24(18)3/h4-5,8-12H,6-7H2,1-3H3,(H2,20,21)	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	350	n/a	n/a	n/a	n/a	8.5	30
H. Lundbeck A/S; Vernalis (R&D) Ltd. US Patent					Assay Description The kinase reaction buffer consists of 50 mM Tris pH 8.5, 0.01% BRIJ-35, 10 mM MgCl2, 1 mM EGTA, and 2 mM DTT. In the assay, 1 nM LRRK2 WT or 250 pM ...				US Patent US9321748 (2016) BindingDB Entry DOI: 10.7270/Q22R3QHC
					More data for this Ligand-Target Pair