BDBM50535647 CHEMBL4442821::US11174248, Example 48

SMILES [H][C@]12COCCN1CCN(C2)c1cc(nc(C)n1)-n1ncc2cnc(cc12)C1(CC2(CC2)C1)C#N

InChI Key InChIKey=ZWEPCKBSNPYEGB-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50535647   

TargetLeucine-rich repeat serine/threonine-protein kinase 2(Human)
Therachem Research Medilab

Curated by ChEMBL
LigandPNGBDBM50535647(CHEMBL4442821 | US11174248, Example 48)
Affinity DataIC50: 20nMAssay Description:Inhibition of GST-tagged truncated human LRRK2 G2019S mutant pre-incubated for 15 mins before fluorescein-labeled peptide substrate LRRKtide addition...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/28/2021
Entry Details Article
PubMed
TargetLeucine-rich repeat serine/threonine-protein kinase 2 [G2019S](Human)
Merck Sharp & Dohme

US Patent
LigandPNGBDBM50535647(CHEMBL4442821 | US11174248, Example 48)
Affinity DataIC50: 20.2nMAssay Description: Assays were performed in the presence of 134 μM ATP (Km ATP). Upon completion, the assay was stopped and phosphorylated substrate detected with...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/3/2022
Entry Details
Go to US Patent