Phosphocholine

Phosphocholine

SCHEMBL3485572

CC(=O)OCC[N+](C)(C)C.C[N+](C)(C)CCOP(=O)([O-])[O-]

nearest known ligand 0.68

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CHRM3

The experimentally established mechanism targets of Phosphocholine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM3 known ✓ P20309 6/20 0.68
CHRM5 P08912 6/20 0.68
CHRM1 P11229 6/20 0.68
CHRM2 P08172 5/20 0.68
CHRM4 P08173 5/20 0.68
CHRNB2 P17787 4/20 0.68
CHRNA4 P43681 4/20 0.68
CHRNA7 P36544 3/20 0.68
SMN1; SMN2 Q16637 3/20 0.68
HTR1A P08908 2/20 0.68
PGR P06401 1/20 0.68
TBXA2R P21731 1/20 0.68
CHRNB4 P30926 1/20 0.68
CHRNA3 P32297 1/20 0.68
CHRNA10 Q9GZZ6 1/20 0.68
CHRNA9 Q9UGM1 1/20 0.68
GALR3 O60755 2/20 0.66
GAA P10253 1/20 0.66
RAB9A P51151 1/20 0.66
ADRA1A P35348 2/20 0.47

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
Acetylcholine SCHEMBL28462551 0.87 CHRM5 (0.80) CHRM5CHRM1CHRM3CHRM2CHRM4
Acetylcholine SCHEMBL1258635 0.85 CHRM5 (0.73) CHRM5CHRM1CHRM3CHRM2CHRM4
Phosphocholine SCHEMBL18192302 0.84 LMNA (0.55) CHRM5CHRM1CHRM3CHRM2CHRM4
Acetylcholine SCHEMBL30066972 0.84 CHRM1 (0.95) CHRM5CHRM1CHRM3CHRM2CHRM4
Phosphocholine SCHEMBL9447039 0.84 LMNA (0.55) CHRM5CHRM1CHRM3CHRM2CHRM4
SCHEMBL19734900 0.84 SMN1; SMN2 (0.60) CHRM5CHRM1CHRM3CHRM2CHRM4
Phosphocholine SCHEMBL3485575 0.84 CHRM5 (0.70) CHRM5CHRM1CHRM3CHRM2CHRM4
Acetylcholine SCHEMBL27531690 0.83 CHRM1 (0.83) CHRM5CHRM1CHRM3CHRM2CHRM4
Phosphocholine SCHEMBL10717808 0.82 LMNA (0.53) CHRM5CHRM1CHRM3CHRM2CHRM4
Phosphocholine SCHEMBL9447028 0.82 LMNA (0.53) CHRM5CHRM1CHRM3CHRM2CHRM4

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9228175-B2 Genes encoding a novel type of lysophophatidylcholine acyltransferases and their use to increase triacylglycerol production and/or modify fatty acid composition NATIONAL RESEARCH COUNSEL OF CANADA (CA) 2016-01-05 US disclosed
US-20130152230-A1 GENES ENCODING A NOVEL TYPE OF LYSOPHOPHATIDYLCHOLINE ACYLTRANSFERASES AND THEIR USE TO INCREASE TRIACYLGLYCEROL PRODUCTION AND/OR MODIFY FATTY ACID COMPOSITION DOW AGROSCIENCES LLC (US) 2013-06-13 US disclosed
US-8383886-B2 Genes encoding a novel type of lysophophatidylcholine acyltransferases and their use to increase triacylglycerol production and/or modify fatty acid composition NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2013-02-26 US disclosed
US-20100016431-A1 GENES ENCODING A NOVEL TYPE OF LYSOPHOPHATIDYLCHOLINE ACYLTRANSFERASES AND THEIR USE TO INCREASE TRIACYLGLYCEROL PRODUCTION AND/OR MODIFY FATTY ACID COMPOSITION NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2010-01-21 US disclosed
WO-2008076377-A2 GENES ENCODING A NOVEL TYPE OF LYSOPHOPHATIDYLCHOLINE ACYLTRANSFERASES AND THEIR USE TO INCREASE TRIACYLGLYCEROL PRODUCTION AND/OR MODIFY FATTY ACID COMPOSITION NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2008-06-26 WO disclosed