Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 3/20 | 0.45 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.45 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.38 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.38 |
| ▸ | MITF | O75030 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4770893 | 1.00 | ADORA2A (0.45) | ADORA2AADORA2BADORA1NPC1RAB9A | |
| SCHEMBL4792653 | 0.94 | NPC1 (0.44) | ADORA2AADORA2BADORA1NPC1RAB9A | |
| SCHEMBL4792657 | 0.94 | NPC1 (0.44) | ADORA2AADORA2BADORA1NPC1RAB9A | |
| SCHEMBL4767911 | 0.91 | NCOA1 (0.42) | ADORA2AADORA2BADORA1NPC1RAB9A | |
| SCHEMBL4767902 | 0.91 | NCOA1 (0.42) | ADORA2AADORA2BADORA1NPC1RAB9A | |
| SCHEMBL4765287 | 0.90 | ADORA2A (0.42) | ADORA2AADORA2BADORA1NPC1RAB9A | |
| SCHEMBL4766274 | 0.86 | NPC1 (0.41) | ADORA2AADORA2BADORA1NPC1RAB9A | |
| SCHEMBL4765291 | 0.86 | NPC1 (0.40) | ADORA2AADORA2BADORA1NPC1RAB9A | |
| SCHEMBL4762619 | 0.86 | SMN1; SMN2 (0.41) | ADORA2AADORA2BADORA1NPC1RAB9A | |
| SCHEMBL4762614 | 0.86 | SMN1; SMN2 (0.41) | ADORA2AADORA2BADORA1NPC1RAB9A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1678181-B1 | A2B ADENOSINE RECEPTOR ANTAGONISTS | CV THERAPEUTICS INC (US) | 2008-12-31 | — | — | EP | disclosed |