Adenosine

Adenosine

SCHEMBL438282

Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O.Nc1ncnc2nc[nH]c12.O=c1cc[nH]c(=O)[nH]1.O=c1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]1

nearest known ligand 0.55

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 0.55
ADORA2A known ✓ P29274 1/20 0.55
ADORA2B known ✓ P29275 1/20 0.55
ADORA1 known ✓ P30542 1/20 0.55
SLC28A1 O00337 2/20 0.55
SLC28A2 O43868 2/20 0.55
SLC29A1 Q99808 2/20 0.55
SLC28A3 Q9HAS3 2/20 0.55
DOT1L Q8TEK3 2/20 0.55
DPP4 P27487 1/20 0.55
MEN1 O00255 1/20 0.55
MAP3K7 O43318 1/20 0.55
GAPDH P04406 1/20 0.55
MAPK1 P28482 1/20 0.55
STAT6 P42226 1/20 0.55
PI4KA P42356 1/20 0.55
KMT2A Q03164 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
PI4K2B Q8TCG2 1/20 0.55
PI4K2A Q9BTU6 1/20 0.55

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 SCHEMBL8023430 0.95 ADORA3 (0.61) ADORA3SLC28A1SLC28A2SLC29A1SLC28A3
Guanosine SCHEMBL27658690 0.91 RNASEL (0.51) ADORA3SLC28A1SLC28A2SLC29A1SLC28A3
Adenosine SCHEMBL17363794 0.87 ADORA3 (0.72) ADORA3SLC28A1SLC28A2SLC29A1SLC28A3
Uridine SCHEMBL3351395 0.87 SLC28A1 (0.65) SLC28A1SLC28A2SLC29A1SLC28A3RNASEL
Adenosine SCHEMBL2248919 0.86 ADORA3 (0.74) ADORA3SLC28A1SLC28A2SLC29A1SLC28A3
Adenosine SCHEMBL8351411 0.86 ADORA3 (0.74) ADORA3SLC28A1SLC28A2SLC29A1SLC28A3
Adenosine SCHEMBL15753116 0.86 ADORA3 (0.56) ADORA3SLC28A1SLC28A2SLC29A1SLC28A3
Adenosine SCHEMBL8023428 0.85 ADORA3 (0.64) ADORA3SLC28A1SLC28A2SLC29A1SLC28A3
Adenosine SCHEMBL536559 0.85 ADORA3 (0.77) ADORA3SLC28A1SLC28A2SLC29A1SLC28A3
Adenosine SCHEMBL9591334 0.83 ADORA3 (0.67) ADORA3SLC28A1SLC28A2SLC29A1SLC28A3

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-20120021043-A1 Nucleic Acids Comprising formula (NuGlXmGnNv)a and Derivatives Thereof as Immunostimulating Agent/Adjuvant CureVac GmbHÛ (DE) 2012-01-26 US disclosed
US-20110250225-A1 COMPOSITION COMPRISING A COMPLEXED (M)RNA AND A NAKED MRNA FOR PROVIDING OR ENHANCING AN IMMUNOSTIMULATORY RESPONSE IN A MAMMAL AND USES THEREOF CUREVAC GMBH 2011-10-13 US disclosed
EP-2331129-A1 COMPOSITION COMPRISING A COMPLEXED (M)RNA AND A NAKED MRNA FOR PROVIDING OR ENHANCING AN IMMUNOSTIMULATORY RESPONSE IN A MAMMAL AND USES THEREOF Curevac GmbH (DE) 2011-06-15 EP disclosed