Phosphocholine

Phosphocholine

SCHEMBL28322352

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

nearest known ligand 0.44

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 8/20 0.44
LPAR2 Q9HBW0 6/20 0.44
SMN1; SMN2 Q16637 2/20 0.40
ADRA1A P35348 2/20 0.40
LMNA P02545 2/20 0.40
ESR1 P03372 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
CDC25A P30304 1/20 0.40
AGTR1 P30556 1/20 0.40
AKT1 P31749 1/20 0.40
KCNH2 Q12809 1/20 0.40
LPAR1 Q92633 4/20 0.39
CHRM5 P08912 3/20 0.38
CHRM1 P11229 3/20 0.38
CHRM3 P20309 3/20 0.38
BBOX1 O75936 2/20 0.38
CHRM2 P08172 2/20 0.38
CHRM4 P08173 2/20 0.38
HTR1A P08908 2/20 0.38
CHRNB2 P17787 2/20 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.

Compoundsimilaritytop predictedshared targets
Phosphocholine SCHEMBL8012 0.89 LPAR3 (0.46) LPAR3LPAR2SMN1; SMN2ADRA1ALMNA
Phosphocholine SCHEMBL15096049 0.89 LPAR3 (0.46) LPAR3LPAR2SMN1; SMN2ADRA1ALMNA
Phosphocholine SCHEMBL14742788 0.89 LPAR3 (0.46) LPAR3LPAR2SMN1; SMN2ADRA1ALMNA
Phosphocholine SCHEMBL31388514 0.87 LPAR3 (0.45) LPAR3LPAR2SMN1; SMN2ADRA1ALMNA
Phosphocholine SCHEMBL30080880 0.87 CHRM5 (0.46) LPAR3LPAR2SMN1; SMN2ADRA1ALMNA
Phosphocholine SCHEMBL30504754 0.87 LPAR3 (0.45) LPAR3LPAR2SMN1; SMN2ADRA1ALMNA
Phosphocholine SCHEMBL8584620 0.87 CHRM5 (0.46) LPAR3LPAR2SMN1; SMN2ADRA1ALMNA
Phosphocholine SCHEMBL24426 0.87 CHRM5 (0.46) LPAR3LPAR2SMN1; SMN2ADRA1ALMNA
Phosphocholine SCHEMBL10935529 0.87 LPAR3 (0.45) LPAR3LPAR2SMN1; SMN2ADRA1ALMNA
Phosphocholine SCHEMBL17373733 0.87 LPAR3 (0.45) LPAR3LPAR2SMN1; SMN2ADRA1ALMNA

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-110251736-A Amphoteric ion polymer brush lubricant and preparation method thereof 南京理工大学 2019-09-20 CN disclosed