Adenosine

Adenosine

SCHEMBL4396199

CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O

nearest known ligand 0.87

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 3/20 0.87
ADORA2A known ✓ P29274 1/20 0.87
ADORA2B known ✓ P29275 1/20 0.87
ADORA1 known ✓ P30542 1/20 0.87
DOT1L Q8TEK3 3/20 0.87
DPP4 P27487 1/20 0.87
MEN1 O00255 1/20 0.87
SLC28A1 O00337 1/20 0.87
MAP3K7 O43318 1/20 0.87
SLC28A2 O43868 1/20 0.87
GAPDH P04406 1/20 0.87
MAPK1 P28482 1/20 0.87
STAT6 P42226 1/20 0.87
PI4KA P42356 1/20 0.87
KMT2A Q03164 1/20 0.87
SMN1; SMN2 Q16637 1/20 0.87
PI4K2B Q8TCG2 1/20 0.87
SLC29A1 Q99808 1/20 0.87
PI4K2A Q9BTU6 1/20 0.87
SLC28A3 Q9HAS3 1/20 0.87

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 SCHEMBL4401875 1.00 ADORA3 (0.87) ADORA3DOT1LDPP4MEN1SLC28A1
Adenosine SCHEMBL6749752 1.00 ADORA3 (0.87) ADORA3DOT1LDPP4MEN1SLC28A1
Adenosine SCHEMBL4138547 0.97 ADORA3 (0.89) ADORA3DOT1LDPP4MEN1SLC28A1
Adenosine SCHEMBL10579680 0.96 ADORA3 (0.87) ADORA3DOT1LDPP4MEN1SLC28A1
Adenosine SCHEMBL9426528 0.94 ADORA3 (0.89) ADORA3DOT1LDPP4MEN1SLC28A1
Adenosine SCHEMBL5034955 0.94 ADORA3 (0.77) ADORA3DOT1LDPP4MEN1SLC28A1
Adenosine SCHEMBL5034951 0.94 ADORA3 (0.77) ADORA3DOT1LDPP4MEN1SLC28A1
Adenosine SCHEMBL28588050 0.94 ADORA3 (0.80) ADORA3DOT1LDPP4MEN1SLC28A1
Adenosine SCHEMBL27849525 0.93 ADORA3 (0.91) ADORA3DOT1LDPP4MEN1SLC28A1
Adenosine SCHEMBL27541540 0.93 ADORA3 (0.95) ADORA3DOT1LDPP4MEN1SLC28A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090131651-A1 Synthesis of 2-substituted adenosines CBT DEVELOPMENT LIMITED (GB) 2009-05-21 US claimed
EP-1694691-A1 IMPROVED SYNTHESIS OF 2-SUBSTITUTED ADENOSINES BIOVITRUM AB (SE) 2006-08-30 EP claimed
WO-2005056571-A1 IMPROVED SYNTHESIS OF 2-SUBSTITUTED ADENOSINES BIOVITRUM AB (SE) 2005-06-23 WO claimed
CN-109310695-B Compounds and methods for treating neurological and cardiovascular conditions 阿斯特罗赛特制药公司 2022-04-01 CN disclosed
US-20090131651-A1 Synthesis of 2-substituted adenosines CBT DEVELOPMENT LIMITED (GB) 2009-05-21 US disclosed
EP-1694691-A1 IMPROVED SYNTHESIS OF 2-SUBSTITUTED ADENOSINES BIOVITRUM AB (SE) 2006-08-30 EP disclosed
WO-2005056571-A1 IMPROVED SYNTHESIS OF 2-SUBSTITUTED ADENOSINES BIOVITRUM AB (SE) 2005-06-23 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-20090131651-A1 Synthesis of 2-substituted adenosines ADORA3, NT5C2, RNGTT ADORA3 1/4885ADORA2A 16/4885ADORA2B 11/4885

“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.