Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 4/20 | 0.48 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.48 |
| ▸ | PIK3C3 | Q8NEB9 | 6/20 | 0.44 |
| ▸ | SYK | P43405 | 2/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | DHODH | Q02127 | 1/20 | 0.42 |
| ▸ | NTRK1 | P04629 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4092710 | 0.80 | NTRK1 (0.42) | AURKAAURKBSYKATMTDP1 | |
| SCHEMBL56941 | 0.80 | NTRK1 (0.60) | PIK3C3NTRK1 | |
| SCHEMBL2506812 | 0.78 | TDP1 (0.46) | ATMTDP1NPC1CYP1A2CYP2C19 | |
| SCHEMBL11900688 | 0.77 | MEN1 (0.61) | ATMTDP1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL11901357 | 0.76 | MEN1 (0.50) | ATMTDP1RAB9ASMN1; SMN2 | |
| SCHEMBL3719662 | 0.75 | AURKA (0.53) | AURKAAURKBPIK3C3EGFRGSK3B | |
| SCHEMBL11902157 | 0.75 | ATM (0.43) | PIK3C3ATMTDP1RAB9ASMN1; SMN2 | |
| SCHEMBL11901159 | 0.74 | HTT (0.47) | ATMTDP1NPC1RAB9A | |
| SCHEMBL3663349 | 0.74 | AURKA (0.49) | AURKAAURKBPIK3C3EGFRGSK3B | |
| SCHEMBL2508268 | 0.73 | ALDH1A1 (0.59) | ATMTDP1RAB9AEGFR |
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 |
|---|---|---|---|---|---|---|---|
| EP-1853588-B1 | CHEMICAL COMPOUNDS | ASTRAZENECA AB (SE) | 2008-06-18 | — | — | EP | disclosed |
| CN-101119988-A | Chemical compound | ASTRAZENECA AB (SE) | 2008-02-06 | — | — | CN | disclosed |