Phosphoric Acid

Phosphoric Acid

SCHEMBL28053197

CCOc1ccc(N)cc1.O=P(O)(O)O

nearest known ligand 0.76

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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
TDP1 Q9NUW8 2/20 0.76
TSHR P16473 1/20 0.76
NPC1 O15118 3/20 0.61
RAB9A P51151 2/20 0.61
TP53 P04637 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
NQO1 P15559 1/20 0.56
PARP10 Q53GL7 1/20 0.53
PLK1 P53350 1/20 0.50
ALDH1A1 P00352 1/20 0.49
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
PRSS1 P07477 1/20 0.48
PRSS2 P07478 1/20 0.48
PRSS3 P35030 1/20 0.48
ADRA2A P08913 2/20 0.47
LTA4H P09960 1/20 0.47

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
SCHEMBL15703 0.87 TDP1 (1.00) TDP1TSHRNPC1RAB9ATP53
Bromide SCHEMBL28053215 0.85 TDP1 (0.95) TDP1TSHRNPC1RAB9ATP53
Hydrochloric Acid SCHEMBL4381222 0.85 TDP1 (0.95) TDP1TSHRNPC1RAB9ATP53
Hydrochloric Acid SCHEMBL2864286 0.85 TDP1 (0.95) TDP1TSHRNPC1RAB9ATP53
Acetic Acid SCHEMBL28053212 0.84 TDP1 (0.76) TDP1TSHRNPC1RAB9ATP53
Sulfuric Acid SCHEMBL28053148 0.84 TSHR (0.76) TDP1TSHRNPC1RAB9ATP53
SCHEMBL11088120 0.81 TDP1 (0.86) TDP1TSHRNPC1RAB9ATP53
SCHEMBL3790560 0.81 TDP1 (0.86) TDP1TSHRNPC1RAB9ATP53
Dimethylamine SCHEMBL656266 0.81 TDP1 (0.86) TDP1TSHRNPC1RAB9ATP53
SCHEMBL6655854 0.81 TSHR (0.70) TDP1TSHRNPC1RAB9ATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105237431-B A kind of preparation of phenaetin and method for crystallising 山东国润生物医药有限公司 2017-11-07 CN disclosed
CN-105237431-A Preparation and crystallization method of phenacetin SHANDONG GREEN BIO PHARMACEUTICAL CO LTD 2016-01-13 CN disclosed