Phosphoric Acid

Phosphoric Acid

SCHEMBL3490778

CSc1nc(N)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1.O=P(O)(O)O

nearest known ligand 0.90

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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 13)

geneUniProtsupporting neighboursconfidence
P2RY1 P47900 6/20 0.73
ENPP1 P22413 3/20 0.73
P2RY12 Q9H244 2/20 0.73
P2RY11 Q96G91 3/20 0.71
P2RX1 P51575 1/20 0.71
P2RX3 P56373 1/20 0.71
P2RY6 Q15077 1/20 0.71
P2RX4 Q99571 1/20 0.71
LMNA P02545 1/20 0.69
BLM P54132 1/20 0.69
KMT2A Q03164 1/20 0.69
NPSR1 Q6W5P4 1/20 0.69
ADORA3 P0DMS8 1/20 0.67

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 SCHEMBL2020883 1.00 P2RY1 (0.73) P2RY1ENPP1P2RY12P2RY11P2RX1
SCHEMBL18089839 0.95 ADORA3 (0.73) LMNAADORA3
SCHEMBL2461484 0.95 ADORA3 (0.73) LMNAADORA3
SCHEMBL10073439 0.95 ADORA3 (0.73) LMNAADORA3
SCHEMBL2461486 0.95 ADORA3 (0.73) LMNAADORA3
Pyrophosphoric Acid SCHEMBL3227391 0.94 P2RY1 (0.79) P2RY1ENPP1P2RY12P2RY11P2RX1
Pyrophosphoric Acid SCHEMBL1321910 0.91 BLM (0.76) P2RY1ENPP1P2RY12P2RY11P2RX1
SCHEMBL2527383 0.87 P2RY1 (0.86) P2RY1ENPP1P2RY12P2RY11P2RX1
SCHEMBL3490789 0.87 P2RY1 (0.86) P2RY1ENPP1P2RY12P2RY11P2RX1
SCHEMBL8862410 0.87 P2RY1 (0.86) P2RY1ENPP1P2RY12P2RY11P2RX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8299097-B2 Methods for treating inflammatory disorders THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2012-10-30 US disclosed
US-20100081684-A1 METHODS FOR TREATING INFLAMMATORY DISORDERS THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2010-04-01 US disclosed
US-7405051-B2 Method of screening antiplatelet agents ASTELLAS PHARMA INC. (JP) 2008-07-29 US disclosed
EP-1331228-B1 METHOD OF SCREENING ANTIPLATELET ASTELLAS PHARMA INC (JP) 2007-03-21 EP disclosed
EP-1331228-A1 METHOD OF SCREENING ANTIPLATELET YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2003-07-30 EP disclosed
US-20030124626-A1 Method of screening antiplatelet ASTELLAS PHARMA INC. (JP) 2003-07-03 US 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-20100081684-A1 METHODS FOR TREATING INFLAMMATORY DISORDERS LTB4R2, LTB4R, LTC4S P2RY1 108/4885ENPP1 542/4885P2RY12 109/4885

“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.