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Sugi Predict / Compounds / Pyrophosphoric Acid

Pyrophosphoric Acid

Pyrophosphoric Acid

SCHEMBL16987380

CC(C)=CCC/C(C)=C/COP(=O)(OC/C=C(\C)CCC=C(C)C)OP(=O)(OC/C=C(\C)CCC=C(C)C)OC/C=C(\C)CCC=C(C)C.O=P(O)(O)OP(=O)(O)O

nearest known ligand 0.73

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Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 18/20 0.73
▸ FNTB P49356 16/20 0.73
▸ PGGT1B P53609 6/20 0.73

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
SCHEMBL335749 0.95 FNTA (0.75) FNTAFNTBPGGT1B
SCHEMBL335748 0.95 FNTA (0.75) FNTAFNTBPGGT1B
SCHEMBL30009312 0.94 FNTA (0.78) FNTAFNTBPGGT1B
SCHEMBL28408955 0.94 FNTA (0.78) FNTAFNTBPGGT1B
Ammonia Solution, Strong SCHEMBL27786620 0.94 FNTA (0.73) FNTAFNTBPGGT1B
SCHEMBL1759376 0.94 FNTA (0.78) FNTAFNTBPGGT1B
SCHEMBL3884435 0.94 FNTA (0.78) FNTAFNTBPGGT1B
SCHEMBL34468137 0.94 FNTA (0.78) FNTAFNTBPGGT1B
Ammonia Solution, Strong SCHEMBL27786619 0.94 FNTA (0.73) FNTAFNTBPGGT1B
SCHEMBL109366 0.94 FNTA (0.67) FNTAFNTBPGGT1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10190140-B2 Increased production of terpenes and terpenoids EVOLVA SA (CH) 2019-01-29 — — US disclosed
US-20180080054-A1 Increased Production of Terpenes and Terpenoids EVOLVA SA (CH) 2018-03-22 — — US disclosed
US-9834800-B2 Increased production of terpenes and terpenoids EVOLVA SA (CH) 2017-12-05 — — US disclosed
US-20150225754-A1 Increased Production of Terpenes and Terpenoids DANSTAR FERMENT AG (CH) 2015-08-13 — — US disclosed