Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.58 |
| ▸ | PSEN1 | P49768 | 4/20 | 0.51 |
| ▸ | PSEN2 | P49810 | 4/20 | 0.51 |
| ▸ | APH1B | Q8WW43 | 4/20 | 0.51 |
| ▸ | NCSTN | Q92542 | 4/20 | 0.51 |
| ▸ | APH1A | Q96BI3 | 4/20 | 0.51 |
| ▸ | PSENEN | Q9NZ42 | 4/20 | 0.51 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.49 |
| ▸ | ROCK2 | O75116 | 7/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.48 |
| ▸ | ROCK1 | Q13464 | 6/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.46 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.46 |
| ▸ | CDK1 | P06493 | 1/20 | 0.46 |
| ▸ | CSF1R | P07333 | 1/20 | 0.46 |
| ▸ | PRKACA | P17612 | 1/20 | 0.46 |
| ▸ | FLT1 | P17948 | 1/20 | 0.46 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL16512502 | 0.88 | AAK1 (0.61) | AAK1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL4535633 | 0.82 | AAK1 (0.56) | AAK1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL10259810 | 0.82 | AAK1 (0.56) | AAK1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL27723715 | 0.82 | AAK1 (0.56) | AAK1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL16370847 | 0.82 | AAK1 (0.66) | AAK1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL16371179 | 0.82 | AAK1 (0.59) | AAK1PSEN1PSEN2APH1BNCSTN | |
| Hydrochloric Acid SCHEMBL4520449 | 0.81 | AAK1 (0.54) | AAK1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL16512501 | 0.81 | CYP17A1 (0.58) | AAK1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL11187399 | 0.81 | AAK1 (0.64) | AAK1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL4516268 | 0.78 | ROCK2 (0.57) | AAK1TAAR1ROCK2ROCK1POLB |
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-2011153588-A1 | VIRAL POLYMERASE INHIBITORS | BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) | 2011-12-15 | — | — | WO | disclosed |