Adenosine

Adenosine

SCHEMBL4138547

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

nearest known ligand 0.89

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 4/20 0.89
ADORA1 known ✓ P30542 3/20 0.89
ADORA2A known ✓ P29274 1/20 0.89
ADORA2B known ✓ P29275 1/20 0.89
SMN1; SMN2 Q16637 2/20 0.89
DOT1L Q8TEK3 2/20 0.89
DPP4 P27487 1/20 0.89
MEN1 O00255 1/20 0.89
SLC28A1 O00337 1/20 0.89
MAP3K7 O43318 1/20 0.89
SLC28A2 O43868 1/20 0.89
GAPDH P04406 1/20 0.89
MAPK1 P28482 1/20 0.89
STAT6 P42226 1/20 0.89
PI4KA P42356 1/20 0.89
KMT2A Q03164 1/20 0.89
PI4K2B Q8TCG2 1/20 0.89
SLC29A1 Q99808 1/20 0.89
PI4K2A Q9BTU6 1/20 0.89
SLC28A3 Q9HAS3 1/20 0.89

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 SCHEMBL10579680 0.97 ADORA3 (0.87) ADORA3ADORA1SMN1; SMN2DOT1LDPP4
Adenosine SCHEMBL6749752 0.97 ADORA3 (0.87) ADORA3ADORA1SMN1; SMN2DOT1LDPP4
Adenosine SCHEMBL4396199 0.97 ADORA3 (0.87) ADORA3ADORA1SMN1; SMN2DOT1LDPP4
Adenosine SCHEMBL4401875 0.97 ADORA3 (0.87) ADORA3ADORA1SMN1; SMN2DOT1LDPP4
Adenosine SCHEMBL27849525 0.94 ADORA3 (0.91) ADORA3ADORA1SMN1; SMN2DOT1LDPP4
Adenosine SCHEMBL27541540 0.94 ADORA3 (0.95) ADORA3ADORA1SMN1; SMN2DOT1LDPP4
Adenosine SCHEMBL23804425 0.94 ADORA3 (1.00) ADORA3ADORA1SMN1; SMN2DOT1LDPP4
Adenosine SCHEMBL4522263 0.94 ADORA3 (1.00) ADORA3ADORA1SMN1; SMN2DOT1LDPP4
Adenosine SCHEMBL1821276 0.94 ADORA3 (1.00) ADORA3ADORA1SMN1; SMN2DOT1LDPP4
Adenosine SCHEMBL24538665 0.94 ADORA3 (1.00) ADORA3ADORA1SMN1; SMN2DOT1LDPP4

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-8946188-B2 Anti-microbial agents and uses thereof SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2015-02-03 US disclosed
US-20140024611-A1 ANTI-MICROBIAL AGENTS AND USES THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2014-01-23 US disclosed
US-8461128-B2 Anti-microbial agents and uses thereof SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2013-06-11 US disclosed
US-20090170805-A1 ANTI-MICROBIAL AGENTS AND USES THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2009-07-02 US disclosed
WO-2006113615-A2 ANTI-MICROBIAL AGENTS AND USES THEREOF SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2006-10-26 WO disclosed
CN-1831002-A Synthesis of novel adenosine polypeptide compounds, and 99Tcm, 186Re tag and tag, and application in tumor treating medicines UNIV BEIJING NORMAL (CN) 2006-09-13 CN 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 (2 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-20140024611-A1 ANTI-MICROBIAL AGENTS AND USES THEREOF ACAT1, ACAT2, APEH ADORA3 831/4885ADORA1 803/4885ADORA2A 653/4885
US-20090170805-A1 ANTI-MICROBIAL AGENTS AND USES THEREOF ACAT1, ACAT2, APEH ADORA3 831/4885ADORA1 803/4885ADORA2A 653/4885

“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.