Phosphoric Acid

Phosphoric Acid

SCHEMBL30844907

Cc1ccc(N)c(C)c1.Cc1ccc(N)c(C)c1.Cc1ccc(N)c(C)c1.O=P(O)(O)O

nearest known ligand 0.50

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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 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 6/20 0.50
CYP3A4 P08684 4/20 0.50
ALOX15 P16050 3/20 0.50
THRB P10828 3/20 0.50
TP53 P04637 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
ALDH1A1 P00352 6/20 0.48
TSHR P16473 3/20 0.48
HSD17B10 Q99714 1/20 0.45
MAPT P10636 3/20 0.43
NPC1 O15118 1/20 0.43
MAPK1 P28482 1/20 0.43
HTT P42858 1/20 0.43
LMNA P02545 2/20 0.41
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
RECQL P46063 1/20 0.40
HIF1A Q16665 1/20 0.40
CA1 P00915 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 SCHEMBL28204018 1.00 TDP1 (0.50) TDP1CYP3A4ALOX15THRBTP53
Methyl Alcohol SCHEMBL11681113 0.86 TDP1 (0.59) TDP1CYP3A4ALOX15THRBTP53
SCHEMBL33980 0.86
SCHEMBL29366708 0.86
Fluoride SCHEMBL18789317 0.84 TDP1 (0.62) TDP1CYP3A4ALOX15THRBTP53
SCHEMBL11239230 0.84 TDP1 (0.62) TDP1CYP3A4ALOX15THRBTP53
Hydrochloric Acid SCHEMBL27406515 0.84 TDP1 (0.62) TDP1CYP3A4ALOX15THRBTP53
Ammonia Solution, Strong SCHEMBL1548755 0.84 TDP1 (0.62) TDP1CYP3A4ALOX15THRBTP53
Hydrochloric Acid SCHEMBL2861056 0.84 TDP1 (0.62) TDP1CYP3A4ALOX15THRBTP53
Hydrochloric Acid SCHEMBL6141790 0.84 TDP1 (0.62) TDP1CYP3A4ALOX15THRBTP53

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-117836432-A Engineered microorganisms for detection of diseased cells 微生物机器公司 2024-04-05 CN disclosed