Phosphoric Acid

Phosphoric Acid

SCHEMBL8344759

Cc1cccc(C)c1OP(=O)(Oc1c(C)cccc1C)Oc1c(C)cccc1C.O=P(O)(O)O.O=P(O)(O)O

nearest known ligand 0.42

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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
INPPL1 O15357 2/20 0.42
INPP5A Q14642 2/20 0.42
INPP5B P32019 1/20 0.42
MAPT P10636 1/20 0.41
CYP3A4 P08684 2/20 0.40
TSHR P16473 2/20 0.40
SRC P12931 2/20 0.40
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.36
MAPK1 P28482 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
AKT1 P31749 1/20 0.35

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
SCHEMBL940949 0.93 MAPT (0.45) INPPL1INPP5AINPP5BMAPTCYP3A4
Phosphoric Acid SCHEMBL28272503 0.87 INPPL1 (0.57) INPPL1INPP5AINPP5BMAPTSRC
SCHEMBL2571511 0.86 INPPL1 (0.42) INPPL1INPP5AINPP5BMAPTSRC
SCHEMBL131318 0.85 CYP3A4 (0.59) MAPTCYP3A4TSHRSRCALDH1A1
SCHEMBL2220467 0.84 INPPL1 (0.59) INPPL1INPP5AINPP5BMAPTSRC
SCHEMBL28397604 0.84 MAPT (0.42) INPPL1INPP5AINPP5BMAPTCYP3A4
SCHEMBL272850 0.84 INPPL1 (0.43) INPPL1INPP5AINPP5BMAPTSRC
SCHEMBL30772416 0.83 MAPT (0.39) INPPL1INPP5AINPP5BMAPTCYP3A4
SCHEMBL29358275 0.83 TRPA1 (0.45) INPPL1INPP5AINPP5BMAPTCYP3A4
SCHEMBL12997458 0.83 MAPT (0.39) MAPTCYP3A4TSHRSRCALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5880308-A REACTING AN AROMATIC MONOHYDROXY COMPOUND WITH EXCESS PHOSPHORUS OXYHALIDE, DISTILLING THE OBTAINED REACTION MIXTURE TO REMOVE BY-PRODUCTS BEFORE THE SECOND TREATMENT; HIGH PURITY; PLASTICIZERS, FIRE RETARDANTS DAIHACHI CHEMICAL INDUSTRY CO., LTD. (JP) 1999-03-09 US disclosed