SCHEMBL28292666

SCHEMBL28292666

N[C](CC(=O)O)c1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]c1=O

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PYGM P11217 3/20 0.60
TK2 O00142 2/20 0.55
SLC28A1 O00337 1/20 0.51
SLC28A2 O43868 1/20 0.51
SLC29A1 Q99808 1/20 0.51
SLC28A3 Q9HAS3 1/20 0.51
P2RY2 P41231 2/20 0.49
TYMP P19971 1/20 0.45
DNPH1 O43598 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16741001 0.87 PYGM (0.66) PYGMTK2SLC28A1SLC28A2SLC29A1
SCHEMBL16740999 0.87 PYGM (0.66) PYGMTK2SLC28A1SLC28A2SLC29A1
SCHEMBL2583512 0.87 PYGM (0.66) PYGMTK2SLC28A1SLC28A2SLC29A1
SCHEMBL16974934 0.87 PYGM (0.69) PYGMTK2SLC28A1SLC28A2SLC29A1
SCHEMBL16974933 0.87 PYGM (0.69) PYGMTK2SLC28A1SLC28A2SLC29A1
SCHEMBL15297980 0.86 PYGM (0.65) PYGMTK2SLC28A1SLC28A2SLC29A1
SCHEMBL157737 0.84 PYGM (0.65) PYGMTK2SLC28A1SLC28A2SLC29A1
SCHEMBL5950109 0.84 PYGM (0.65) PYGMTK2SLC28A1SLC28A2SLC29A1
SCHEMBL25241091 0.82 PYGM (0.66) PYGMTK2SLC28A1SLC28A2SLC29A1
SCHEMBL2587057 0.82 PYGM (0.66) PYGMTK2SLC28A1SLC28A2SLC29A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105849083-B [ S, S ] -EDDS biosynthetic genes and proteins and methods for the biosynthesis of [ S, S ] -EDDS E·施特格曼 2019-05-21 CN disclosed