Pyrophosphoric Acid

Pyrophosphoric Acid

SCHEMBL28838063

O=P(O)(O)O.O=P(O)(O)OP(=O)(O)O.c1c[nH]cn1

nearest known ligand 0.54

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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 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.54
FKBP5 Q13451 1/20 0.54
FDPS P14324 1/20 0.42
BLM P54132 1/20 0.42
TDP1 Q9NUW8 1/20 0.42

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 SCHEMBL2482818 0.98 ALDH1A1 (0.56) ALDH1A1FKBP5FDPSBLMTDP1
Pyrophosphoric Acid SCHEMBL17216548 0.98 ALDH1A1 (0.56) ALDH1A1FKBP5FDPSBLMTDP1
Pyrophosphoric Acid SCHEMBL8011246 0.98 ALDH1A1 (0.56) ALDH1A1FKBP5FDPSBLMTDP1
Pyrophosphoric Acid SCHEMBL17260502 0.92 ALDH1A1 (0.50) ALDH1A1FKBP5FDPSBLMTDP1
Triphosphate SCHEMBL22659158 0.90 ALDH1A1 (0.52) ALDH1A1FKBP5FDPSBLMTDP1
Phosphoric Acid SCHEMBL1090914 0.89 ALDH1A1 (0.68) ALDH1A1FKBP5
Phosphoric Acid SCHEMBL22659156 0.89 ALDH1A1 (0.68) ALDH1A1FKBP5
Phosphoric Acid SCHEMBL29042477 0.89 ALDH1A1 (0.68) ALDH1A1FKBP5
Phosphoric Acid SCHEMBL1352614 0.89 ALDH1A1 (0.68) ALDH1A1FKBP5
Phosphoric Acid SCHEMBL27850773 0.89 ALDH1A1 (0.68) ALDH1A1FKBP5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115011113-A Flame-retardant material and preparation method thereof 江苏集萃先进高分子材料研究所有限公司 2022-09-06 CN disclosed
CN-111040245-B Pyropolyphosphoric acid imidazole flame retardant and preparation method thereof 江苏集萃先进高分子材料研究所有限公司 2022-05-31 CN disclosed
CN-111040245-A Pyropolyphosphoric acid imidazole flame retardant and preparation method thereof 江苏集萃先进高分子材料研究所有限公司 2020-04-21 CN disclosed