Adenosine

Adenosine

SCHEMBL28057366

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

nearest known ligand 0.67

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
ADORA1 known ✓ P30542 3/20 0.67
ADORA3 known ✓ P0DMS8 3/20 0.67
ADORA2A known ✓ P29274 1/20 0.67
ADORA2B known ✓ P29275 1/20 0.67
SMN1; SMN2 Q16637 3/20 0.67
DPP4 P27487 1/20 0.67
MEN1 O00255 1/20 0.67
SLC28A1 O00337 1/20 0.67
MAP3K7 O43318 1/20 0.67
SLC28A2 O43868 1/20 0.67
GAPDH P04406 1/20 0.67
MAPK1 P28482 1/20 0.67
STAT6 P42226 1/20 0.67
PI4KA P42356 1/20 0.67
KMT2A Q03164 1/20 0.67
PI4K2B Q8TCG2 1/20 0.67
DOT1L Q8TEK3 1/20 0.67
SLC29A1 Q99808 1/20 0.67
PI4K2A Q9BTU6 1/20 0.67
SLC28A3 Q9HAS3 1/20 0.67

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 SCHEMBL2327105 0.96 ADORA3 (0.72) ADORA1ADORA3SMN1; SMN2DPP4MEN1
Adenosine SCHEMBL26612876 0.96 ADORA3 (0.72) ADORA1ADORA3SMN1; SMN2DPP4MEN1
Adenosine SCHEMBL28241706 0.96 ADORA3 (0.71) ADORA1ADORA3SMN1; SMN2DPP4MEN1
Adenosine SCHEMBL9419203 0.95 ADORA1 (0.63) ADORA1ADORA3SMN1; SMN2DPP4MEN1
Adenosine SCHEMBL27686613 0.94 P2RY2 (0.65) ADORA1ADORA3SMN1; SMN2DPP4MEN1
Adenosine SCHEMBL29036082 0.94 ADORA3 (0.71) ADORA1ADORA3SMN1; SMN2DPP4MEN1
Adenosine SCHEMBL347374 0.94 ADORA3 (0.71) ADORA1ADORA3SMN1; SMN2DPP4MEN1
Adenosine SCHEMBL18953147 0.91 P2RY2 (0.62) ADORA1ADORA3SMN1; SMN2DPP4MEN1
Adenosine Phosphate SCHEMBL5988433 0.90 P2RY1 (0.76) ADORA1SMN1; SMN2P2RY1P2RY2SRC
Xylose SCHEMBL27858312 0.90 ADORA1 (0.68) ADORA1ADORA3SMN1; SMN2DPP4MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105524608-B A kind of fluorescence probe AH and its preparation and application 中国科学院大连化学物理研究所 2017-09-22 CN claimed
CN-105524608-A Fluorescent probe AH and preparation and application thereof DALIAN INST CHEMICAL PHYSICS CAS 2016-04-27 CN claimed
CN-105524608-B A kind of fluorescence probe AH and its preparation and application 中国科学院大连化学物理研究所 2017-09-22 CN disclosed
CN-105524608-B A kind of fluorescence probe AH and its preparation and application 中国科学院大连化学物理研究所 2017-09-22 CN disclosed
CN-105524608-A Fluorescent probe AH and preparation and application thereof DALIAN INST CHEMICAL PHYSICS CAS 2016-04-27 CN disclosed