Phosphorylethanolamine

Phosphorylethanolamine

SCHEMBL9802188

NCCOP(=O)(O)O.NCCOP(=O)(O)O.[Mg]

nearest known ligand 0.44

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Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 8/20 0.44
LPAR2 Q9HBW0 6/20 0.44
LPAR1 Q92633 4/20 0.44
TPI1 P60174 2/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.36
CYP3A4 P08684 1/20 0.36
NFKB1 P19838 1/20 0.36
BLM P54132 1/20 0.36
PMP22 Q01453 1/20 0.36
GABBR2 O75899 1/20 0.36
GABBR1 Q9UBS5 1/20 0.36
PGD P52209 1/20 0.35

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
Phosphorylethanolamine SCHEMBL20798002 0.97 LPAR3 (0.46) LPAR3LPAR2LPAR1TPI1ALDH1A1
Phosphorylethanolamine SCHEMBL44347 0.97
Phosphorylethanolamine SCHEMBL31158295 0.97
Phosphorylethanolamine SCHEMBL29598224 0.94 LPAR3 (0.44) LPAR3LPAR2LPAR1TPI1ALDH1A1
Phosphorylethanolamine SCHEMBL7203183 0.94
Phosphorylethanolamine SCHEMBL29903196 0.94
Phosphorylethanolamine SCHEMBL10724664 0.94
Phosphorylethanolamine SCHEMBL8341244 0.94
Phosphorylethanolamine SCHEMBL9801949 0.94 LPAR3 (0.44) LPAR3LPAR2LPAR1TPI1ALDH1A1
Phosphorylethanolamine SCHEMBL30169660 0.94

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
US-5068228-A Nervous system disorders KOEHLER GERNOT (DE) 1991-11-26 US disclosed