Known targets — ChEMBL curated mechanism
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)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 known ✓ | P30542 | 3/20 | 0.52 |
| ▸ | ADORA3 known ✓ | P0DMS8 | 1/20 | 0.52 |
| ▸ | ADORA2A known ✓ | P29274 | 1/20 | 0.52 |
| ▸ | ADORA2B known ✓ | P29275 | 1/20 | 0.52 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | DPP4 | P27487 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | SLC28A1 | O00337 | 1/20 | 0.52 |
| ▸ | MAP3K7 | O43318 | 1/20 | 0.52 |
| ▸ | SLC28A2 | O43868 | 1/20 | 0.52 |
| ▸ | GAPDH | P04406 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | STAT6 | P42226 | 1/20 | 0.52 |
| ▸ | PI4KA | P42356 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.52 |
| ▸ | DOT1L | Q8TEK3 | 1/20 | 0.52 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.52 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.52 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Adenosine SCHEMBL15347371 | 0.97 | HSP90AA1 (0.57) | HSP90AA1ADORA1SMN1; SMN2DPP4MEN1 | |
| Cocarboxylase SCHEMBL14636148 | 0.90 | LMNA (0.63) | SMN1; SMN2RNASELTDP1P2RY1P2RY2 | |
| Adenosine SCHEMBL675657 | 0.90 | LMNA (0.62) | SMN1; SMN2RNASELTDP1P2RY1P2RY2 | |
| Adenosine SCHEMBL2702312 | 0.88 | LMNA (0.56) | SMN1; SMN2RNASELTDP1P2RY1P2RY2 | |
| Hydrochloric Acid SCHEMBL7793647 | 0.87 | TDP1 (0.55) | RNASELTDP1TKTLMNA | |
| SCHEMBL6862756 | 0.84 | TDP1 (0.53) | ADORA1SMN1; SMN2RNASELTDP1P2RY1 | |
| SCHEMBL14636151 | 0.84 | TKT (0.56) | ADORA1SMN1; SMN2RNASELTDP1P2RY1 | |
| SCHEMBL675658 | 0.83 | LMNA (0.58) | ADORA1SMN1; SMN2RNASELTDP1P2RY1 | |
| SCHEMBL31005215 | 0.83 | P2RY1 (0.56) | SMN1; SMN2RNASELP2RY1P2RY2SRC | |
| Thiamine Ion SCHEMBL6266534 | 0.78 | HSP90AA1 (0.87) | HSP90AA1TDP1TKTLMNAALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1410302-A2 | CLASSIFICATION OF POLYPEPTIDES BY LIGAND GEOMETRY AND RELATED METHODS | Triad Therapeutics, Inc. (US) | 2004-04-21 | — | — | EP | claimed |
| US-20030236630-A1 | Classification of polypeptides by ligand geometry and related methods | TRIAD THERAPEUTICS, INC. | 2003-12-25 | — | — | US | claimed |
| US-20020133296-A1 | Classification of polypeptides by ligand geometry and related methods | TRIAD THERAPEUTICS, INC. | 2002-09-19 | — | — | US | claimed |
| WO-2002056236-A2 | CLASSIFICATION OF POLYPEPTIDES BY LIGAND GEOMETRY AND RELATED METHODS | TRIAD THERAPEUTICS INC (US) | 2002-07-18 | — | — | WO | claimed |