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 = 'BDBM548559'
TargetLeucine-rich repeat serine/threonine-protein kinase 2 [G2019S](Homo sapiens (Human))
MERCK SHARP & DOHME LLC

WIPO
LigandPNGBDBM548559(WO2022093881, Ex-10.68)
Show SMILES C[C@@]1(COC[C@H]1F)N1CCN(CC1)c1cc2cc(NC(=O)[C@@H]3CC[C@H]3C#N)ncc2cc1Cl
Show InChI InChI=1S/C24H27ClFN5O2/c1-24(14-33-13-21(24)26)31-6-4-30(5-7-31)20-9-16-10-22(28-12-17(16)8-19(20)25)29-23(32)18-3-2-15(18)11-27/h8-10,12,15,18,21H,2-7,13-14H2,1H3,(H,28,29,32)/t15-,18+,21+,24-/m0/s1
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