BDBM525555 5-(1-(6-((3S,4s,5R and 3R,4s,5S)-4-hydroxy- 3,4,5-trimethylpiperidin- 1-yl)pyrimidin-4-yl)-1H- indazol-6- yl)spiro[2.3]hexane-5- carbonitrile*::US11174248, Example 17

SMILES C[C@H]1CN(C[C@@H](C)[C@@]1(C)O)c1cc(ncn1)-n1ncc2ccc(cc12)C1(CC2(CC2)C1)C#N

InChI Key InChIKey=OTTQIZSIIWVEFQ-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 = 525555   

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

US Patent
LigandPNGBDBM525555(5-(1-(6-((3S,4s,5R and 3R,4s,5S)-4-hydroxy- 3,4,5-...)
Affinity DataIC50: 8.90nMAssay 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
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