Phosphoric Acid

Phosphoric Acid

SCHEMBL4523004

C=CCO[C@]1(O)C[C@H](n2cc(C)c(=O)[nH]c2=O)O[C@@H]1CO.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O

nearest known ligand 0.48

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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 9)

geneUniProtsupporting neighboursconfidence
TK1 P04183 4/20 0.48
TYMP P19971 4/20 0.44
LMNA P02545 2/20 0.43
TSHR P16473 2/20 0.43
ALB P02768 1/20 0.43
PKM P14618 1/20 0.43
BLM P54132 1/20 0.43
PMP22 Q01453 1/20 0.43
CYP2D6 P10635 1/20 0.43

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
SCHEMBL4523006 0.85 POLB (0.55) TK1
SCHEMBL8996145 0.82 TK1 (0.51) TK1LMNATSHRALBPKM
SCHEMBL31653931 0.81 TK1 (0.43) TK1LMNATSHRALBPKM
Phosphoric Acid SCHEMBL1445017 0.80 TK1 (0.53) TK1TYMPLMNATSHRALB
SCHEMBL8356495 0.79 TK1 (0.47) TK1LMNATSHRALBPKM
SCHEMBL29529503 0.79 TK1 (0.53) TK1TYMPLMNATSHRALB
SCHEMBL13407948 0.78 TK1 (0.49) TK1LMNATSHRALBPKM
SCHEMBL6394877 0.77 LMNA (0.52) TK1LMNATSHRALBPKM
SCHEMBL5086587 0.77 LMNA (0.52) TK1LMNATSHRALBPKM
SCHEMBL933253 0.76 TK1 (0.53) TK1

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
US-9909177-B2 Pyrosequencing methods and related compositions THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2018-03-06 US disclosed
US-20160312279-A1 PYROSEQUENCING METHODS AND RELATED COMPOSITIONS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK 2016-10-27 US disclosed
US-9169510-B2 Pyrosequencing methods and related compositions THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2015-10-27 US disclosed
US-20090325154-A1 Pyrosequencing Methods and Related Compositions THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2009-12-31 US disclosed
WO-2007002204-A2 PYROSEQUENCING METHODS AND RELATED COMPOSTIONS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2007-01-04 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090325154-A1 Pyrosequencing Methods and Related Compositions RNGTT, DNMT3A, NT5C3B TK1 289/4885TYMP 38/4885LMNA 1409/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.