Pyrophosphoric Acid

Pyrophosphoric Acid

SCHEMBL1994741

O=P(O)(O)OP(=O)(O)O.O=P([O-])([O-])[O-].[K+].[Na+].[Na+]

nearest known ligand 0.67

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Known targets — ChEMBL curated mechanism

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

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

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.67
BLM P54132 1/20 0.67
TDP1 Q9NUW8 1/20 0.67
SLC34A1 Q06495 1/20 0.50
KDM4E B2RXH2 1/20 0.36
CYP2C19 P33261 1/20 0.36
KMT2A Q03164 1/20 0.36
LMNA P02545 2/20 0.35
CA4 P22748 3/20 0.35
CA1 P00915 2/20 0.35
CA5A P35218 2/20 0.35
CA5B Q9Y2D0 2/20 0.35
PEPD P12955 1/20 0.32
BTN3A1 O00481 1/20 0.30

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
Pyrophosphoric Acid SCHEMBL2113857 0.97 FDPS (0.71) FDPSBLMTDP1SLC34A1KDM4E
Pyrophosphoric Acid SCHEMBL5575855 0.97 FDPS (0.71) FDPSBLMTDP1SLC34A1KDM4E
Pyrophosphoric Acid SCHEMBL27132925 0.93 FDPS (0.67) FDPSBLMTDP1SLC34A1KDM4E
Pyrophosphoric Acid SCHEMBL28978110 0.93 FDPS (0.67) FDPSBLMTDP1SLC34A1KDM4E
Pyrophosphoric Acid SCHEMBL28511969 0.93 FDPS (0.67) FDPSBLMTDP1SLC34A1KDM4E
Pyrophosphoric Acid SCHEMBL28833809 0.90 FDPS (0.62) FDPSBLMTDP1SLC34A1KDM4E
Pyrophosphoric Acid SCHEMBL3906363 0.90 FDPS (0.62) FDPSBLMTDP1SLC34A1KDM4E
Pyrophosphoric Acid SCHEMBL31539936 0.90 FDPS (0.62) FDPSBLMTDP1SLC34A1KDM4E
Pyrophosphoric Acid SCHEMBL28706087 0.90 FDPS (0.62) FDPSBLMTDP1SLC34A1KDM4E
Pyrophosphoric Acid SCHEMBL9400188 0.90 FDPS (0.71) FDPSBLMTDP1SLC34A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130202713-A1 COATING OF PARTICLES COMPRISING A PHARMACEUTICALLY ACTIVE INGREDIENT WITH A CARBONATE SALT OR PHOSPHATE SALT LEK PHARMACEUTICALS D.D. (SI) 2013-08-08 US disclosed
US-20130115301-A1 COATING OF PARTICLES COMPRISING A PHARMACEUTICALLY ACTIVE INGREDIENT WITH A CARBONATE SALT OR PHOSPHATE SALT JAMNIK, Janko (SI) 2013-05-09 US disclosed
EP-2515885-A1 COATING OF PARTICLES COMPRISING A PHARMACEUTICALLY ACTIVE INGREDIENT WITH A CARBONATE SALT OR PHOSPHATE SALT LEK Pharmaceuticals d.d. (SI) 2012-10-31 EP disclosed
EP-2515884-A1 COATING OF PARTICLES COMPRISING A PHARMACEUTICALLY ACTIVE INGREDIENT WITH A CARBONATE SALT OR PHOSPHATE SALT LEK Pharmaceuticals d.d. (SI) 2012-10-31 EP disclosed
WO-2011076743-A1 COATING OF PARTICLES COMPRISING A PHARMACEUTICALLY ACTIVE INGREDIENT WITH A CARBONATE SALT OR PHOSPHATE SALT LEK PHARMACEUTICALS D.D. (SI) 2011-06-30 WO disclosed
WO-2011076738-A1 COATING OF PARTICLES COMPRISING A PHARMACEUTICALLY ACTIVE INGREDIENT WITH A CARBONATE SALT OR PHOSPHATE SALT LEK PHARMACEUTICALS D.D. (SI) 2011-06-30 WO disclosed
EP-2338480-A1 Coating of particles comprising a pharmaceutically active ingredient with a carbonate salt or phosphate salt LEK Pharmaceuticals d.d. (SI) 2011-06-29 EP disclosed