Phosphorylethanolamine

SCHEMBL993264

CCCCCCCCCCCCCCC(=O)C(O)(C(=O)CCCCCCCCCCCCCC)[C@@H](O)CO.NCCOP(=O)(O)O

nearest known ligand 0.44

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	LPAR3	Q9UBY5	7/20	0.44

▸	LPAR1	Q92633	6/20	0.44

▸	LPAR2	Q9HBW0	4/20	0.44

▸	ENPP2	Q13822	7/20	0.42

▸	LPAR5	Q9H1C0	2/20	0.42

▸	LPAR6	P43657	1/20	0.42

▸	LPAR4	Q99677	1/20	0.42

▸	PLA2G2C	Q5R387	1/20	0.39

▸	PLA2G4A	P47712	1/20	0.39

▸	SMN1; SMN2	Q16637	1/20	0.38

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.

Compound	similarity	top predicted	shared targets
Phosphorylethanolamine SCHEMBL19412013	0.98	LPAR3 (0.42)	LPAR3LPAR1LPAR2ENPP2LPAR5
Phosphocholine SCHEMBL28083494	0.86	FABP3 (0.45)	LPAR3LPAR1LPAR2SMN1; SMN2
Phosphocholine SCHEMBL27650431	0.86	FABP3 (0.45)	LPAR3LPAR1LPAR2SMN1; SMN2
Phosphocholine SCHEMBL8791526	0.86	FABP3 (0.45)	LPAR3LPAR1LPAR2SMN1; SMN2
Pyrophosphoric Acid SCHEMBL8723088	0.84	LPAR1 (0.42)	LPAR3LPAR1LPAR2ENPP2LPAR5
Pyrophosphoric Acid SCHEMBL7264840	0.84	LPAR1 (0.42)	LPAR3LPAR1LPAR2ENPP2LPAR5
Phosphoric Acid SCHEMBL28471288	0.84	FAAH (0.44)	—
Phosphoric Acid SCHEMBL28324933	0.84	FAAH (0.44)	—
Phosphoric Acid SCHEMBL1664876	0.84	FAAH (0.44)	—
Phosphoric Acid SCHEMBL7807537	0.84	FAAH (0.44)	—

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.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
WO-2011008857-A1	SiRNA PHOSPHOLIPID CONJUGATE	NORTHEASTERN UNIVERSITY (US)	2011-01-20	—	—	WO	disclosed