SCHEMBL28279797

SCHEMBL28279797

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nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PYGB P11216 8/20 0.40
PYGL P06737 3/20 0.40
PYGM P11217 2/20 0.40
FBP1 P09467 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL28851205 1.00 PYGB (0.40) PYGBPYGLPYGMFBP1MEN1
SCHEMBL515356 1.00 PYGB (0.40) PYGBPYGLPYGMFBP1MEN1
SCHEMBL1932762 0.95 ADSS2 (0.35) PYGBPYGLPYGMFBP1MEN1
SCHEMBL28991003 0.95 ADSS2 (0.35) PYGBPYGLPYGMFBP1MEN1
SCHEMBL23111917 0.95 ADSS2 (0.35) PYGBPYGLPYGMFBP1MEN1
Sulfuric Acid SCHEMBL29192736 0.94 PYGB (0.36) PYGBPYGLPYGMFBP1MEN1
SCHEMBL8838940 0.85 FBP1 (0.36) FBP1
SCHEMBL4312544 0.79 PYGB (0.40) PYGBPYGLPYGM
SCHEMBL29655015 0.79 PYGB (0.40) PYGBPYGLPYGMFBP1
SCHEMBL10385012 0.78 PYGB (0.42) PYGBPYGLPYGMMEN1KMT2A

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-109328297-A Container assemblies and the preparation method of sample for using the container assemblies 株式会社岛津制作所 2019-02-12 CN disclosed