Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA3 | P22001 | 1/20 | 0.60 |
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | TP53 | P04637 | 2/20 | 0.54 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.50 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | HCN1 | O60741 | 1/20 | 0.48 |
| ▸ | HCN4 | Q9Y3Q4 | 1/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | BCL2 | P10415 | 4/20 | 0.47 |
| ▸ | BCL2L1 | Q07817 | 4/20 | 0.47 |
| ▸ | MCL1 | Q07820 | 4/20 | 0.47 |
| ▸ | BCL2A1 | Q16548 | 4/20 | 0.47 |
| ▸ | BAK1 | Q16611 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7976400 | 0.88 | KCNA3 (0.76) | KCNA3NPC1RAB9ATP53ROCK2 | |
| SCHEMBL5158992 | 0.88 | KCNA3 (0.76) | KCNA3NPC1RAB9ATP53ROCK2 | |
| SCHEMBL24598470 | 0.84 | TP53 (0.74) | KCNA3NPC1RAB9ATP53HPGD | |
| SCHEMBL14977077 | 0.82 | NPC1 (0.52) | KCNA3NPC1RAB9ATP53ROCK2 | |
| SCHEMBL5157294 | 0.77 | KCNA3 (0.75) | KCNA3NPC1RAB9ATP53HPGD | |
| SCHEMBL6207609 | 0.76 | NPC1 (0.71) | KCNA3NPC1RAB9ATP53HPGD | |
| SCHEMBL6207605 | 0.76 | NPC1 (0.71) | KCNA3NPC1RAB9ATP53HPGD | |
| SCHEMBL14976802 | 0.75 | MEN1 (0.61) | NPC1RAB9ATP53ROCK2ROCK1 | |
| SCHEMBL2208134 | 0.74 | NPC1 (0.65) | KCNA3NPC1RAB9ATP53BCL2 | |
| SCHEMBL24598450 | 0.74 | TP53 (0.63) | KCNA3TP53ALDH1A1POLB |
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-2013075173-A1 | COMPOUNDS FOR THE TREATMENT OF HCV | BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) | 2013-05-30 | — | — | WO | disclosed |