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 = 'BDBM548484'
TargetLeucine-rich repeat serine/threonine-protein kinase 2 [G2019S](Homo sapiens (Human))
MERCK SHARP & DOHME LLC

WIPO
LigandPNGBDBM548484(WO2022093881, Ex-9.14)
Show SMILES C[C@H]1[C@@H](C1c1cnn(C)c1)C(=O)Nc1cc2cc(N3CCN(CC3)C3(C)CCOC3)c(C)cc2cn1
Show InChI InChI=1S/C28H36N6O2/c1-18-11-21-14-29-24(31-27(35)26-19(2)25(26)22-15-30-32(4)16-22)13-20(21)12-23(18)33-6-8-34(9-7-33)28(3)5-10-36-17-28/h11-16,19,25-26H,5-10,17H2,1-4H3,(H,29,31,35)/t19-,25?,26+,28?/m1/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