Phosphoric Acid

Phosphoric Acid

SCHEMBL7197200

COc1cccc(C[P+](c2ccccc2C)(c2ccccc2C)c2ccccc2C)c1.COc1cccc(C[P+](c2ccccc2C)(c2ccccc2C)c2ccccc2C)c1.COc1cccc(C[P+](c2ccccc2C)(c2ccccc2C)c2ccccc2C)c1.O=P([O-])([O-])[O-]

nearest known ligand 0.46

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Known targets — ChEMBL curated mechanism

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

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

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SCN8A known ✓ Q9UQD0 1/20 0.41
TAAR1 Q96RJ0 3/20 0.46
IDH1 O75874 1/20 0.41
CMA1 P23946 1/20 0.40
ATM Q13315 1/20 0.40
IDO1 P14902 2/20 0.40
AGXT P21549 2/20 0.40
CHRM2 P08172 3/20 0.39
CHRM1 P11229 2/20 0.39
CHRM3 P20309 2/20 0.39
MMP13 P45452 1/20 0.39
MAOB P27338 1/20 0.39
FDFT1 P37268 1/20 0.39

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
Phosphoric Acid SCHEMBL9318697 0.91 MAOB (0.39) TAAR1SCN8AIDH1CMA1ATM
Hydrochloric Acid SCHEMBL7195761 0.90 TAAR1 (0.51) TAAR1SCN8AIDH1CMA1IDO1
Bromide SCHEMBL7197342 0.90 TAAR1 (0.51) TAAR1SCN8AIDH1CMA1IDO1
Iodide SCHEMBL7197231 0.90 TAAR1 (0.51) TAAR1SCN8AIDH1CMA1IDO1
Acetic Acid SCHEMBL8750052 0.88 TAAR1 (0.44) TAAR1IDH1ATMMMP13
Phosphoric Acid SCHEMBL9318706 0.88 MAOB (0.38) TAAR1IDH1ATMMMP13MAOB
Acetic Acid SCHEMBL7195824 0.86 MTNR1A (0.45) TAAR1IDH1
Succinic Acid SCHEMBL7195815 0.86 TAAR1 (0.43) TAAR1IDH1ATM
Phosphoric Acid SCHEMBL7201586 0.85 L3MBTL1 (0.45) SCN8AATM
Phosphoric Acid SCHEMBL7195799 0.81 LAP3 (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0624173-B2 PRECATALYZED CATALYST COMPOSITIONS, PROCESS FOR PREPARING RESINS DOW CHEMICAL CO (US) 2003-04-09 EP disclosed
EP-0624173-B1 PRECATALYZED CATALYST COMPOSITIONS, PROCESS FOR PREPARING RESINS DOW CHEMICAL CO (US) 1997-04-02 EP disclosed
EP-0624173-A1 PRECATALYZED CATALYST COMPOSITIONS, PROCESS FOR PREPARING RESINS. DOW CHEMICAL CO (US) 1994-11-17 EP disclosed
US-5360886-A Alklyphenylphosphine or phosphonium catalyst THE DOW CHEMICAL COMPANY (US) 1994-11-01 US disclosed
WO-1993015126-A1 PRECATALYZED CATALYST COMPOSITIONS, PROCESS FOR PREPARING RESINS THE DOW CHEMICAL COMPANY (US) 1993-08-05 WO disclosed
US-5202407-A Phosphonium or phosphine catalyst having at least three alkylphenyl groups attached to phosphorus atom THE DOW CHEMICAL COMPANY (US) 1993-04-13 US disclosed