Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 3/20 | 0.50 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.45 |
| ▸ | CKS1B | P61024 | 1/20 | 0.44 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 2/20 | 0.40 |
| ▸ | TTK | P33981 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | PKLR | P30613 | 1/20 | 0.39 |
| ▸ | PTK6 | Q13882 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | MAPKAPK5 | Q8IW41 | 1/20 | 0.38 |
| ▸ | NPY5R | Q15761 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | FYN | P06241 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL14164724 | 0.82 | AURKA (0.49) | AURKAAURKBCKS1BSKP2ALDH1A1 | |
| SCHEMBL14164502 | 0.81 | AURKA (0.50) | AURKACKS1BSKP2ALDH1A1GAA | |
| SCHEMBL14241367 | 0.78 | AURKA (0.45) | AURKAAURKBCKS1BSKP2ALDH1A1 | |
| SCHEMBL14164727 | 0.78 | AURKA (0.46) | AURKAAURKBCKS1BSKP2ALDH1A1 | |
| SCHEMBL3467955 | 0.76 | TTK (0.50) | AURKAALDH1A1GAAMEN1KMT2A | |
| SCHEMBL25447222 | 0.74 | TTK (0.57) | AURKAAURKBGAATTKTP53 | |
| SCHEMBL5619102 | 0.74 | FLT3 (0.54) | AURKAAURKBCDK2TTKFYN | |
| SCHEMBL8240320 | 0.71 | FYN (0.52) | AURKAAURKBTTKPTK6MAPKAPK5 | |
| SCHEMBL14164713 | 0.71 | ALDH1A1 (0.43) | AURKACKS1BSKP2ALDH1A1MEN1 | |
| SCHEMBL5618383 | 0.71 | TTK (0.48) | AURKAAURKBTTKFYN |
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-2012168733-A1 | SUBSTITUTED 8 - AMINO - IMIDAZO [1, 2-A] PYRAZINES AS ANTIBACTERIAL AGENTS | UCL BUSINESS PLC (GB) | 2012-12-13 | — | — | WO | disclosed |