Phosphoric Acid

Phosphoric Acid

SCHEMBL8413692

CCCC[N+](CC)(CCCC)CCCC.CCCC[N+](CC)(CCCC)CCCC.CCCC[N+](CC)(CCCC)CCCC.O=P([O-])([O-])[O-]

nearest known ligand 0.55

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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 20)

geneUniProtsupporting neighboursconfidence
ADRA1A known ✓ P35348 1/20 0.38
KCNH2 known ✓ Q12809 1/20 0.38
KCNA1 known ✓ Q09470 1/20 0.35
SLC22A1 O15245 3/20 0.55
DNM1 Q05193 5/20 0.52
SLC22A2 O15244 1/20 0.48
TSHR P16473 2/20 0.43
ALDH1A1 P00352 1/20 0.43
TP53 P04637 1/20 0.43
CYP3A4 P08684 1/20 0.43
ALOX15 P16050 1/20 0.43
ALOX12 P18054 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HIF1A Q16665 1/20 0.43
HSD17B10 Q99714 1/20 0.43
LMNA P02545 1/20 0.38
ESR1 P03372 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
CDC25A P30304 1/20 0.38
AGTR1 P30556 1/20 0.38

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 SCHEMBL2373400 0.95 DNM1 (0.61) SLC22A1DNM1SLC22A2TSHRALDH1A1
Phosphoric Acid SCHEMBL31669648 0.95 DNM1 (0.59) SLC22A1DNM1SLC22A2TSHRALDH1A1
Phosphoric Acid SCHEMBL7641438 0.95 SLC22A1 (0.55) SLC22A1DNM1SLC22A2TSHRALDH1A1
Phosphoric Acid SCHEMBL10632843 0.93 SLC22A1 (0.48) SLC22A1DNM1SLC22A2TSHRALDH1A1
Tetrabuthylammonium SCHEMBL19834900 0.89 SLC22A1 (0.71) SLC22A1DNM1SLC22A2TSHRALDH1A1
Tetrabuthylammonium SCHEMBL49814 0.89 SLC22A1 (0.71) SLC22A1DNM1SLC22A2TSHRALDH1A1
SCHEMBL20543356 0.88 DNM1 (0.52) SLC22A1DNM1SLC22A2TSHRALDH1A1
Phosphoric Acid SCHEMBL1203422 0.87 DNM1 (0.71) SLC22A1DNM1SLC22A2TSHRALDH1A1
Phosphoric Acid SCHEMBL8911224 0.87 SLC22A1 (0.52) SLC22A1DNM1SLC22A2TSHRALDH1A1
Tetrabuthylammonium SCHEMBL3141779 0.86 SLC22A1 (0.67) SLC22A1DNM1SLC22A2TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0931856-A2 Process for reductive coupling in an electrolytic cell with a cathode comprising an iron-based substrate and a lead-based coating BASF AKTIENGESELLSCHAFT (DE) 1999-07-28 EP disclosed
US-5593557-A ELECTROHYDRODIMERIZATION OF ACRYLONITRILE BASF AKTIENGESELLSCHAFT (DE) 1997-01-14 US disclosed
EP-0635587-A1 Electrode comprising an iron containing substrate and a lead containing coating BASF Aktiengesellschaft (DE) 1995-01-25 EP disclosed
US-4789442-A ELECTROHYDRODIMERIZATION OF ACRYLONITRILE; CORROSION RESISTANCE ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1988-12-06 US disclosed
EP-0270390-A2 A method for producing adiponitrile Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1988-06-08 EP disclosed