Adenosine

Adenosine

SCHEMBL20529823

NCCCCCCNc1nc2c(N)ncnc2n1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O.O=P(O)(O)O

nearest known ligand 0.69

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADORA1ADORA2AADORA2BADORA3

The experimentally established mechanism targets of Adenosine. 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
▸ ADORA3 known ✓ P0DMS8 1/20 0.60
▸ ADORA2A known ✓ P29274 1/20 0.60
▸ ADORA2B known ✓ P29275 1/20 0.60
▸ ADORA1 known ✓ P30542 1/20 0.60
▸ FBP1 P09467 1/20 0.69
▸ SLC28A2 O43868 4/20 0.60
▸ DPP4 P27487 1/20 0.60
▸ MEN1 O00255 1/20 0.60
▸ SLC28A1 O00337 1/20 0.60
▸ MAP3K7 O43318 1/20 0.60
▸ GAPDH P04406 1/20 0.60
▸ MAPK1 P28482 1/20 0.60
▸ STAT6 P42226 1/20 0.60
▸ PI4KA P42356 1/20 0.60
▸ KMT2A Q03164 1/20 0.60
▸ SMN1; SMN2 Q16637 1/20 0.60
▸ PI4K2B Q8TCG2 1/20 0.60
▸ DOT1L Q8TEK3 1/20 0.60
▸ SLC29A1 Q99808 1/20 0.60
▸ PI4K2A Q9BTU6 1/20 0.60

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 SCHEMBL20529828 0.94 P2RY1 (0.65) FBP1ADORA1SMN1; SMN2RNASEL
SCHEMBL20529826 0.90 P2RY1 (0.65) FBP1ADORA1SMN1; SMN2RNASEL
Adenosine Phosphate SCHEMBL31666008 0.90 P2RY1 (0.69) FBP1ADORA1SMN1; SMN2RNASEL
SCHEMBL5924576 0.89 FBP1 (0.72) FBP1SLC28A2HSPA8HSPA5RXFP1
SCHEMBL5924577 0.89 FBP1 (0.72) FBP1SLC28A2HSPA8HSPA5RXFP1
SCHEMBL8388000 0.83 FBP1 (0.64) FBP1ADORA1SMN1; SMN2
SCHEMBL20266254 0.83 FBP1 (0.63) FBP1ADORA1SMN1; SMN2
Adenosine SCHEMBL9147194 0.82 ADORA1 (0.89) FBP1SLC28A2DPP4MEN1SLC28A1
Adenosine SCHEMBL459769 0.82 ADORA1 (0.89) FBP1SLC28A2DPP4MEN1SLC28A1
Adenosine SCHEMBL6242700 0.82 ADORA1 (0.89) FBP1SLC28A2DPP4MEN1SLC28A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200054741-A1 PEPTIDE-BASED VACCINES, METHODS OF MANUFACTURING, AND USES THEREOF FOR INDUCING AN IMMUNE RESPONSE AVIDEA TECHNOLOGIES, INC. (US) 2020-02-20 — — US disclosed
EP-3606551-A1 PEPTIDE-BASED VACCINES, METHODS OF MANUFACTURING, AND USES THEREOF FOR INDUCING AN IMMUNE RESPONSE Avidea Technologies, Inc. (US) 2020-02-12 — — EP disclosed
WO-2018187515-A1 PEPTIDE-BASED VACCINES, METHODS OF MANUFACTURING, AND USES THEREOF FOR INDUCING AN IMMUNE RESPONSE AVIDEA TECHNOLOGIES, INC. (US) 2018-10-11 — — 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-20200054741-A1 PEPTIDE-BASED VACCINES, METHODS OF MANUFACTURING, AND USES THEREOF FOR INDUCING AN IMMUNE RESPONSE MYD88, ICOS, CD4 ADORA3 4678/4885ADORA2A 4805/4885ADORA2B 4656/4885

“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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