Compile Data Set for Download or QSAR
Found 1 Enz. Inhib. hit(s) with Target = 'Leucine-rich repeat serine/threonine-protein kinase 2 [G2019S]' and Ligand = 'BDBM548491'
TargetLeucine-rich repeat serine/threonine-protein kinase 2 [G2019S](Homo sapiens (Human))
MERCK SHARP & DOHME LLC

WIPO
LigandPNGBDBM548491(WO2022093881, Ex-9.21)
Show SMILES Cc1cc2cnc(NC(=O)C3CC3c3ccccn3)cc2cc1N1CCN(CC1)C1(C)CCOC1
Show InChI InChI=1S/C28H33N5O2/c1-19-13-21-17-30-26(31-27(34)23-16-22(23)24-5-3-4-7-29-24)15-20(21)14-25(19)32-8-10-33(11-9-32)28(2)6-12-35-18-28/h3-5,7,13-15,17,22-23H,6,8-12,16,18H2,1-2H3,(H,30,31,34)
Affinity DataIC50: 0.0800nMAssay Description: The LRRK2 kinase activity reported herein as IC50 values was determined with LanthaScreen™ technology from Life Technologies Corporation (Carlsbad, ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails PubMed