Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 9/20 | 0.68 |
| ▸ | CNR2 | P34972 | 3/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | GRM6 | O15303 | 2/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 7/20 | 0.45 |
| ▸ | ADORA2B | P29275 | 7/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.45 |
| ▸ | RORB | Q92753 | 3/20 | 0.42 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3974619 | 0.93 | ADORA1 (0.67) | ADORA1CNR2MAPTMEN1ALDH1A1 | |
| SCHEMBL4090650 | 0.91 | ADORA1 (0.77) | ADORA1CNR2MAPTMEN1ALDH1A1 | |
| SCHEMBL4086503 | 0.88 | ADORA1 (0.72) | ADORA1CNR2MAPTMEN1ALDH1A1 | |
| SCHEMBL4076833 | 0.85 | ADORA1 (0.66) | ADORA1CNR2MAPTMEN1ALDH1A1 | |
| SCHEMBL4078131 | 0.85 | ADORA1 (0.68) | ADORA1CNR2MAPTMEN1ALDH1A1 | |
| SCHEMBL3981712 | 0.85 | GRM6 (0.57) | ADORA1MAPTMEN1ALDH1A1CYP1A2 | |
| SCHEMBL4080808 | 0.81 | ADORA1 (0.75) | ADORA1CNR2MAPTMEN1ALDH1A1 | |
| SCHEMBL4091366 | 0.81 | ADORA1 (1.00) | ADORA1CNR2MAPTMEN1ALDH1A1 | |
| SCHEMBL3976889 | 0.80 | ADORA1 (0.46) | ADORA1CNR2MAPTMEN1ALDH1A1 | |
| SCHEMBL3975104 | 0.77 | GRM6 (0.60) | ADORA1MAPTMEN1ALDH1A1CYP1A2 |
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 |