Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.47 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.47 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.47 |
| ▸ | SREBF2 | Q12772 | 4/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 6/20 | 0.35 |
| ▸ | PI4KA | P42356 | 5/20 | 0.35 |
| ▸ | PI4KB | Q9UBF8 | 5/20 | 0.35 |
| ▸ | PIK3CD | O00329 | 4/20 | 0.35 |
| ▸ | PIK3CB | P42338 | 4/20 | 0.35 |
| ▸ | PIK3CG | P48736 | 3/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | HEXA | P06865 | 1/20 | 0.35 |
| ▸ | HEXB | P07686 | 1/20 | 0.35 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 1/20 | 0.33 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL13629967 | 0.88 | ADORA3 (0.50) | ADORA3ADORA2AADORA2BADORA1PIK3CA | |
| SCHEMBL13615797 | 0.81 | ADORA3 (0.46) | ADORA3ADORA2AADORA2BADORA1PIK3CA | |
| SCHEMBL20390358 | 0.80 | ADORA3 (0.59) | ADORA3ADORA2AADORA2BADORA1PIK3CA | |
| SCHEMBL3657653 | 0.79 | ADORA3 (0.47) | ADORA3ADORA2AADORA2BADORA1PIK3CA | |
| SCHEMBL12681394 | 0.76 | ADORA3 (0.54) | ADORA3ADORA2AADORA2BADORA1PIK3CA | |
| SCHEMBL12680080 | 0.74 | ADORA3 (0.51) | ADORA3ADORA2AADORA2BADORA1PIK3CA | |
| SCHEMBL15071926 | 0.73 | ADORA3 (0.50) | ADORA3ADORA2AADORA2BADORA1PIK3CA | |
| SCHEMBL20391019 | 0.73 | ADORA3 (0.62) | ADORA3ADORA2AADORA2BADORA1PIK3CA | |
| SCHEMBL20390356 | 0.72 | SREBF2 (0.50) | SREBF2ALDH1A1MAPTATML3MBTL1 | |
| SCHEMBL18822208 | 0.70 | PRMT5 (0.41) | PIK3CAPI4KAPI4KBPIK3CDPIK3CB |
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-2009137737-A2 | ANTI-BACTERIAL ACTIVITY OF 9-HYDROXY DERIVATIVES OF 6, 11-BICYCLOLIDES | ENANTA PHARMACEUTICALS, INC. (US) | 2009-11-12 | — | — | WO | disclosed |