Phosphoric Acid

Phosphoric Acid

SCHEMBL27747448

CCCCCCCCCCCCCC(=O)[N+](C)(C)CCCN.CCCCCCCCCCCCCC(=O)[N+](C)(C)CCCN.CCCCCCCCCCCCCC(=O)[N+](C)(C)CCCN.O=P([O-])([O-])[O-]

nearest known ligand 0.43

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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 0.37
KCNH2 known ✓ Q12809 1/20 0.37
CES2 O00748 4/20 0.42
CES1 P23141 4/20 0.42
DNM1 Q05193 4/20 0.38
ALDH1A1 P00352 2/20 0.38
TSHR P16473 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
EPHX1 P07099 1/20 0.38
LMNA P02545 1/20 0.37
ESR1 P03372 1/20 0.37
ADORA3 P0DMS8 1/20 0.37
CDC25A P30304 1/20 0.37
AGTR1 P30556 1/20 0.37
AKT1 P31749 1/20 0.37
SLC22A6 Q4U2R8 1/20 0.37
SLC22A8 Q8TCC7 1/20 0.37
GPR84 Q9NQS5 1/20 0.37
PPARG P37231 1/20 0.37

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
SCHEMBL3232950 0.93 CES2 (0.43) CES2CES1DNM1ALDH1A1TSHR
SCHEMBL19639123 0.93 CES2 (0.43) CES2CES1DNM1ALDH1A1TSHR
SCHEMBL7215359 0.93 CES2 (0.43) CES2CES1DNM1ALDH1A1TSHR
Hydrochloric Acid SCHEMBL28890816 0.92 CES2 (0.42) CES2CES1DNM1ALDH1A1TSHR
Hydrochloric Acid SCHEMBL6048090 0.87 DNM1 (0.45) CES2CES1DNM1ALDH1A1TSHR
SCHEMBL19639136 0.84 CES2 (0.45) CES2CES1ALDH1A1TSHRMEN1
Sulfuric Acid Diethyl Ester SCHEMBL27705731 0.81 ENPP2 (0.35) CES2CES1
Hydrochloric Acid SCHEMBL28345403 0.81 CES2 (0.48) CES2CES1DNM1ALDH1A1TSHR
Phosphoric Acid SCHEMBL28625324 0.80 CES2 (0.41) CES2CES1DNM1LMNAESR1
SCHEMBL29391004 0.79 CES2 (0.50) CES2CES1ALDH1A1TSHRMEN1

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
CN-101489524-A Method and composition for permanently shaping hair PROCTER & GAMBLE (US) 2009-07-22 CN disclosed