Pyrophosphoric Acid

Pyrophosphoric Acid

SCHEMBL8993614

N=C(N)N.N=C(N)N.O=P(O)(O)OP(=O)(O)O

nearest known ligand 0.67

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Known targets — ChEMBL curated mechanism

KCNA1KCNA10KCNA2KCNA3KCNA4KCNA5KCNA6KCNA7KCNB1KCNB2KCNC1KCNC2KCNC3KCNC4KCND1KCND2KCND3KCNF1KCNG1KCNG2KCNG3KCNG4KCNH1KCNH2KCNH3KCNH4KCNH5KCNH6KCNH7KCNH8KCNQ1KCNQ2KCNQ3KCNQ4KCNQ5KCNS1KCNS2KCNS3KCNV1KCNV2

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 7)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.67
BLM P54132 1/20 0.67
TDP1 Q9NUW8 1/20 0.67
CA4 P22748 1/20 0.43
TPI1 P60174 1/20 0.33
PGD P52209 1/20 0.30
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 SCHEMBL19458367 1.00 FDPS (0.67) FDPSBLMTDP1CA4TPI1
Pyrophosphoric Acid SCHEMBL229477 1.00 FDPS (0.67) FDPSBLMTDP1CA4TPI1
Pyrophosphoric Acid SCHEMBL2407700 1.00 FDPS (0.67) FDPSBLMTDP1CA4TPI1
Triphosphate SCHEMBL122712 0.88 FDPS (0.50) FDPSBLMTDP1CA4TPI1
Triphosphate SCHEMBL8023890 0.88 FDPS (0.50) FDPSBLMTDP1CA4TPI1
Guanidine SCHEMBL32685203 0.85 FDPS (0.47) FDPSBLMTDP1CA4TPI1
Pyrophosphoric Acid SCHEMBL19458364 0.83 FDPS (0.53) FDPSBLMTDP1CA4
Pyrophosphoric Acid SCHEMBL4147800 0.83 TDP1 (0.71) FDPSBLMTDP1CA4TPI1
Pyrophosphoric Acid SCHEMBL8416891 0.82 FDPS (0.83) FDPSBLMTDP1CA4TPI1
Pyrophosphoric Acid SCHEMBL10770702 0.82 FDPS (0.83) FDPSBLMTDP1CA4TPI1

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
EP-2338923-B1 Polyurethane with a biocidal polyuric material as comonomer OBERWALDER SEBASTIAN (DE) 2017-10-18 EP claimed
CN-109963885-B Guanidine diphosphate and guanidine polyphosphate ligands and group IV metal catalysts produced therefrom 陶氏环球技术有限责任公司 2022-06-14 CN disclosed
EP-0725065-A2 Process for the preparation of guanidine or melamine phosphates DSM Chemie Linz GmbH (AT) 1996-08-07 EP disclosed