Known targets — ChEMBL curated mechanism
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
The experimentally established mechanism targets of Adenine. 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 | |
|---|---|---|---|---|
| ▸ | DPP4 known ✓ | P27487 | 1/20 | 0.45 |
| ▸ | FBP1 | P09467 | 1/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | SLC28A1 | O00337 | 1/20 | 0.45 |
| ▸ | MAP3K7 | O43318 | 1/20 | 0.45 |
| ▸ | SLC28A2 | O43868 | 1/20 | 0.45 |
| ▸ | GAPDH | P04406 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.45 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.45 |
| ▸ | STAT6 | P42226 | 1/20 | 0.45 |
| ▸ | PI4KA | P42356 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.45 |
| ▸ | DOT1L | Q8TEK3 | 1/20 | 0.45 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Adenine SCHEMBL14636444 | 0.94 | HIF1A (0.49) | ADORA1HIF1AADORA3SMN1; SMN2DPP4 | |
| Adenine SCHEMBL1035727 | 0.80 | PI4KA (0.40) | FBP1ADORA1ADORA2API4KAPI4K2B | |
| Adenine SCHEMBL338435 | 0.80 | PI4KA (0.40) | FBP1ADORA1ADORA2API4KAPI4K2B | |
| Adenine SCHEMBL283728 | 0.80 | PI4KA (0.40) | FBP1ADORA1ADORA2API4KAPI4K2B | |
| Ribose (Furanose) SCHEMBL2505730 | 0.80 | ADK (0.40) | ADORA1HIF1AADORA3SMN1; SMN2DPP4 | |
| Ribose (Furanose) SCHEMBL4542668 | 0.80 | ADK (0.40) | ADORA1HIF1AADORA3SMN1; SMN2DPP4 | |
| 2,6-Diaminopurine SCHEMBL8153506 | 0.79 | HIF1A (0.42) | ADORA1HIF1AADORA3ADORA2AADORA2B | |
| 2,6-Diaminopurine SCHEMBL10774599 | 0.79 | HIF1A (0.42) | ADORA1HIF1AADORA3ADORA2AADORA2B | |
| Adenine SCHEMBL8509836 | 0.79 | PI4KA (0.39) | FBP1ADORA1ADORA2API4KAPI4K2B | |
| Adenine SCHEMBL2411187 | 0.79 | PI4KA (0.39) | FBP1ADORA1ADORA2API4KAPI4K2B |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0737077-A1 | HEPATOCYTE-TARGETED DRUG CONJUGATES | TARGETECH, INC. (US) | 1996-10-16 | — | — | EP | disclosed |
| WO-1995018636-A2 | HEPATOCYTE-TARGETED DRUG CONJUGATES | TARGETECH INC (US) | 1995-07-13 | — | — | WO | disclosed |