Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 2/20 | 0.44 |
| ▸ | CNR2 | P34972 | 2/20 | 0.38 |
| ▸ | RORB | Q92753 | 5/20 | 0.37 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | RORC | P51449 | 1/20 | 0.35 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | IKBKB | O14920 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3976889 | 0.93 | ADORA1 (0.46) | ADORA1CNR2RORBALDH1A1MEN1 | |
| SCHEMBL4090647 | 0.89 | ADORA1 (0.46) | ADORA1CNR2RORBALDH1A1MAOB | |
| SCHEMBL4078130 | 0.86 | ADORA1 (0.40) | ADORA1RORBMAPTMAOBRORC | |
| SCHEMBL4076829 | 0.86 | RORB (0.41) | ADORA1RORBALDH1A1MEN1KMT2A | |
| SCHEMBL3974619 | 0.79 | ADORA1 (0.67) | ADORA1CNR2RORBALDH1A1MEN1 | |
| SCHEMBL4091364 | 0.79 | ADORA1 (0.56) | ADORA1CNR2RORBMAPTMAOB | |
| SCHEMBL4080804 | 0.79 | ADORA1 (0.43) | ADORA1CNR2RORBMAPTMAOB | |
| SCHEMBL3975104 | 0.74 | GRM6 (0.60) | ADORA1GPR52ALDH1A1MEN1KMT2A | |
| SCHEMBL3976892 | 0.72 | ADORA1 (0.68) | ADORA1CNR2RORBALDH1A1MEN1 | |
| SCHEMBL4085898 | 0.72 | ADORA1 (0.42) | ADORA1CNR2RORBALDH1A1MAOB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009049362-A1 | A1 ADENOSINE RECEPTOR ALLOSTERIC ENHANCERS | MONASH UNIVERSITY (AU) | 2009-04-23 | — | — | WO | disclosed |