BDBM267966 (3aR,5R,6S,7R,7aR)-5-(((1H-pyrazol- 3-yl)amino)methyl)-2-(methylamino)- 5,6,7,7a-tetrahydro-3aH-pyrano[3,2- d]thiazole-6,7-diol::US9718854, 57

SMILES CNC1=N[C@H]2[C@H](O[C@H](CNc3cc[nH]n3)[C@@H](O)[C@@H]2O)S1

InChI Key

Data  1 KI

  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 1 hit for monomerid = 267966   

Target4-hydroxy-2-oxoglutarate aldolase, mitochondrial(Homo sapiens (Human))
Alectos Therapeutics

US Patent
LigandPNGBDBM267966((3aR,5R,6S,7R,7aR)-5-(((1H-pyrazol- 3-yl)amino)met...)
Affinity DataKi:  6.80nM ΔG°:  -11.1kcal/molepH: 7.0 T: 2°CAssay Description:Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent