Pyrophosphoric Acid

Pyrophosphoric Acid

SCHEMBL8080994

C=CCOCC(CO)OCCCCC.O=P(O)(O)OP(=O)(O)O

nearest known ligand 0.50

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Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 9/20 0.50
LPAR1 Q92633 8/20 0.50
CNR1 P21554 2/20 0.43
CNR2 P34972 2/20 0.43
ALDH1A1 P00352 1/20 0.43
LPAR2 Q9HBW0 5/20 0.41
LPAR5 Q9H1C0 3/20 0.39
LPAR6 P43657 2/20 0.39
LPAR4 Q99677 2/20 0.39
PLA2G2C Q5R387 1/20 0.36

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
SCHEMBL566245 0.89 CNR1 (0.51) LPAR3LPAR1CNR1CNR2ALDH1A1
SCHEMBL2524076 0.89 CNR1 (0.51) LPAR3LPAR1CNR1CNR2ALDH1A1
Pyrophosphoric Acid SCHEMBL15661576 0.86 LPAR3 (0.66) LPAR3LPAR1CNR1CNR2ALDH1A1
SCHEMBL8080988 0.85 LPAR3 (0.58) LPAR3LPAR1LPAR2LPAR5LPAR6
SCHEMBL2519029 0.84 LPAR3 (0.72) LPAR3LPAR1LPAR2LPAR5LPAR6
SCHEMBL10773792 0.84 LPAR3 (0.72) LPAR3LPAR1LPAR2LPAR5LPAR6
SCHEMBL3261983 0.77 LPAR3 (0.74) LPAR3LPAR1LPAR2LPAR5LPAR6
SCHEMBL1534300 0.77 LPAR3 (0.74) LPAR3LPAR1LPAR2LPAR5LPAR6
SCHEMBL7784745 0.77 USP2 (0.50) LPAR3LPAR1CNR1CNR2ALDH1A1
Phosphoric Acid SCHEMBL9136512 0.77 LPAR1 (0.69) LPAR3LPAR1CNR1CNR2ALDH1A1

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
EP-0350287-B1 Lipid derivatives of antiviral nucleosides, liposomal incorporation and method of use CHIMERIX INC (US) 2000-09-27 EP disclosed