Phosphocholine

Phosphocholine

SCHEMBL10935529

C[N+](C)(C)CCOP(=O)(O)O.C[N+](C)(C)CCOP(=O)(O)O.[O-2]

nearest known ligand 0.45

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 4/20 0.45
LPAR1 Q92633 2/20 0.45
LPAR2 Q9HBW0 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
ADRA1A P35348 2/20 0.44
LMNA P02545 2/20 0.44
ESR1 P03372 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
CDC25A P30304 1/20 0.44
AGTR1 P30556 1/20 0.44
AKT1 P31749 1/20 0.44
KCNH2 Q12809 1/20 0.44
CHRM5 P08912 6/20 0.43
CHRM1 P11229 6/20 0.43
CHRM3 P20309 6/20 0.43
CHRM2 P08172 5/20 0.43
CHRM4 P08173 5/20 0.43
CHRNB2 P17787 4/20 0.43
CHRNA4 P43681 4/20 0.43
CHRNA7 P36544 3/20 0.43

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 SCHEMBL14742788 0.98 LPAR3 (0.46) LPAR3LPAR1LPAR2SMN1; SMN2ADRA1A
Phosphocholine SCHEMBL8012 0.98 LPAR3 (0.46) LPAR3LPAR1LPAR2SMN1; SMN2ADRA1A
Phosphocholine SCHEMBL15096049 0.98 LPAR3 (0.46) LPAR3LPAR1LPAR2SMN1; SMN2ADRA1A
Phosphocholine SCHEMBL28883972 0.95 LPAR3 (0.45) LPAR3LPAR1LPAR2SMN1; SMN2ADRA1A
Phosphocholine SCHEMBL31388514 0.95 LPAR3 (0.45) LPAR3LPAR1LPAR2SMN1; SMN2ADRA1A
Phosphocholine SCHEMBL8584620 0.95 CHRM5 (0.46) LPAR3LPAR1LPAR2SMN1; SMN2ADRA1A
Phosphocholine SCHEMBL24426 0.95 CHRM5 (0.46) LPAR3LPAR1LPAR2SMN1; SMN2ADRA1A
Phosphocholine SCHEMBL30080880 0.95 CHRM5 (0.46) LPAR3LPAR1LPAR2SMN1; SMN2ADRA1A
Phosphocholine SCHEMBL30504754 0.95 LPAR3 (0.45) LPAR3LPAR1LPAR2SMN1; SMN2ADRA1A
Phosphocholine SCHEMBL17373733 0.95 LPAR3 (0.45) LPAR3LPAR1LPAR2SMN1; SMN2ADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-60255705-A None JP disclosed
JP-S60255705-A PLANT GROWTH REGULATOR MITSUBISHI GAS CHEM CO INC 1985-12-17 JP disclosed