Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 2/20 | 0.46 |
| ▸ | AURKA | O14965 | 3/20 | 0.44 |
| ▸ | RPS6KB1 | P23443 | 3/20 | 0.44 |
| ▸ | HTR1A | P08908 | 3/20 | 0.41 |
| ▸ | PARP1 | P09874 | 2/20 | 0.40 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.40 |
| ▸ | PARP2 | Q9UGN5 | 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 | |
|---|---|---|---|---|
| SCHEMBL8516651 | 0.92 | AURKA (0.46) | PIN1AURKARPS6KB1PARP1AURKB | |
| SCHEMBL2798590 | 0.82 | PIN1 (0.49) | PIN1AURKARPS6KB1PARP1AURKB | |
| SCHEMBL3462221 | 0.82 | PIN1 (0.49) | PIN1AURKARPS6KB1PARP1AURKB | |
| SCHEMBL3460627 | 0.82 | PIN1 (0.49) | PIN1AURKARPS6KB1PARP1AURKB | |
| SCHEMBL4276692 | 0.74 | PIN1 (0.42) | PIN1AURKARPS6KB1PARP1AURKB | |
| SCHEMBL7251899 | 0.74 | AURKA (0.48) | AURKARPS6KB1HTR1APARP1AURKB | |
| SCHEMBL484230 | 0.74 | AURKA (0.48) | AURKARPS6KB1HTR1APARP1AURKB | |
| SCHEMBL2984209 | 0.73 | IDO1 (0.48) | — | |
| SCHEMBL78935 | 0.72 | IDO1 (0.44) | — | |
| SCHEMBL29499774 | 0.71 | NTRK1 (0.41) | AURKARPS6KB1 |
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-1999052857-A1 | NOVEL COMPOUNDS | SMITHKLINE BEECHAM PLC (GB) | 1999-10-21 | — | — | WO | disclosed |