Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 5/20 | 0.53 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.53 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.46 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.46 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.46 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.46 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.46 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.44 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.44 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.42 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 4/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3399237 | 0.87 | ADORA2A (0.68) | ADORA2AADORA1GABRA1GABRG2GABRB3 | |
| SCHEMBL2325695 | 0.87 | ADORA2A (0.67) | ADORA2AADORA1GABRA1GABRG2GABRB3 | |
| SCHEMBL31009002 | 0.87 | ADORA2A (0.67) | ADORA2AADORA1GABRA1GABRG2GABRB3 | |
| SCHEMBL3398025 | 0.81 | RAB9A (0.53) | ADORA2AADORA1NPC1RAB9AALDH1A1 | |
| SCHEMBL2324638 | 0.81 | ADORA2A (0.53) | ADORA2AADORA1DHFR | |
| SCHEMBL30186623 | 0.81 | KDM4E (0.53) | ADORA2AADORA1GABRG2GABRB3GABRA5 | |
| SCHEMBL2323257 | 0.81 | KDM4E (0.53) | ADORA2AADORA1GABRG2GABRB3GABRA5 | |
| SCHEMBL19871627 | 0.80 | ADORA2A (0.76) | ADORA2AADORA1CYP1A1CYP1B1MAOA | |
| SCHEMBL3399073 | 0.79 | CYP1A2 (0.64) | ADORA2AADORA1CYP1A1CYP1B1KDM4E | |
| SCHEMBL24218092 | 0.78 | ADORA2A (0.80) | ADORA2AADORA1CYP1A1CYP1B1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010046780-A2 | ANTI VIRAL COMPOUNDS | INSTITUT PASTEUR KOREA (KR) | 2010-04-29 | — | — | WO | disclosed |
| WO-2010046780-A2 | ANTI VIRAL COMPOUNDS | INSTITUT PASTEUR KOREA (KR) | 2010-04-29 | — | — | WO | disclosed |