BDBM525576 (S)-5-(1-(6- (hexahydropyrazino[2,1- c][1,4]oxazin-8(1H)- yl)pyrimidin-4-yl)-1H- pyrazolo[4,3-c]pyridin-6- yl)spiro[2.3]hexane-5- carbonitrile::US11174248, Example 49

SMILES N#CC1(CC2(CC2)C1)c1cc2n(ncc2cn1)-c1cc(ncn1)N1CCN2CCOC[C@@H]2C1

InChI Key InChIKey=AQTHQUQYHWXCTI-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 525576   

TargetLeucine-rich repeat serine/threonine-protein kinase 2 [G2019S](Human)
Merck Sharp & Dohme

US Patent
LigandPNGBDBM525576((S)-5-(1-(6- (hexahydropyrazino[2,1- c][1,4]oxazin...)
Affinity DataIC50: 8.80nMAssay 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
US Patent