Adenosine Triphosphate

Adenosine Triphosphate

SCHEMBL3779481

Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=C(O)[C@@H]1CCCN1

nearest known ligand 0.78

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SLC5A2

The experimentally established mechanism targets of Adenosine Triphosphate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ P2RY1 P47900 6/20 0.72
▸ P2RY2 P41231 2/20 0.72
▸ P2RX1 P51575 2/20 0.72
▸ P2RX3 P56373 2/20 0.72
▸ P2RX2 Q9UBL9 2/20 0.72
▸ SRC P12931 1/20 0.72
▸ P2RX4 Q99571 1/20 0.72
▸ ALDH1A1 P00352 1/20 0.72
▸ SMN1; SMN2 Q16637 1/20 0.72
▸ RNASEL Q05823 1/20 0.69
▸ MACROD2 A1Z1Q3 1/20 0.68
▸ SIRT6 Q8N6T7 1/20 0.68
▸ MACROD1 Q9BQ69 1/20 0.68
▸ TRPM2 O94759 1/20 0.68
▸ PARG Q86W56 1/20 0.68
▸ EPRS1 P07814 2/20 0.66

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
Adenosine Phosphate SCHEMBL15670457 0.93 P2RY1 (0.75) P2RY1P2RY2P2RX1P2RX3P2RX2
SCHEMBL30168548 0.88 P2RY1 (0.69) P2RY1P2RY2P2RX1P2RX3P2RX2
Adenosine Triphosphate SCHEMBL28252560 0.88 P2RY1 (0.91) P2RY1P2RY2P2RX1P2RX3P2RX2
Adenosine Triphosphate SCHEMBL8979 0.87 P2RY1 (0.94) P2RY1P2RY2P2RX1P2RX3P2RX2
Adenosine Triphosphate SCHEMBL8980 0.87 P2RY1 (0.94) P2RY1P2RY2P2RX1P2RX3P2RX2
SCHEMBL4366441 0.87 P2RY1 (0.94) P2RY1P2RY2P2RX1P2RX3P2RX2
Adenosine Triphosphate SCHEMBL468214 0.87 P2RY1 (0.94) P2RY1P2RY2P2RX1P2RX3P2RX2
Adenosine Triphosphate SCHEMBL20550531 0.87 P2RY1 (0.94) P2RY1P2RY2P2RX1P2RX3P2RX2
SCHEMBL376009 0.87 P2RY1 (0.94) P2RY1P2RY2P2RX1P2RX3P2RX2
Adenosine Triphosphate SCHEMBL13722139 0.87 P2RY1 (0.94) P2RY1P2RY2P2RX1P2RX3P2RX2

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
US-8211873-B2 Antiaging chirally-correct mitoprotectant amino acid and peptide complexes ISLAND KINETICS, INC. (US) 2012-07-03 — — US disclosed
US-20100331274-A1 Antiaging Chirally-Correct Mitoprotectant Amino Acid and Peptide Complexes ISLAND KINETICS INC. (US) 2010-12-30 — — 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-20100331274-A1 Antiaging Chirally-Correct Mitoprotectant Amino Acid and Peptide Complexes COL14A1, CUTA, POLK P2RY1 4670/4885P2RY2 4770/4885P2RX1 4803/4885

“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.

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