Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTK6 | Q13882 | 6/20 | 0.41 |
| ▸ | AURKB | Q96GD4 | 4/20 | 0.40 |
| ▸ | AURKA | O14965 | 2/20 | 0.40 |
| ▸ | BCL6 | P41182 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | MAPKAPK5 | Q8IW41 | 3/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | BRD2 | P25440 | 1/20 | 0.35 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.35 |
| ▸ | LCK | P06239 | 1/20 | 0.35 |
| ▸ | IKBKB | O14920 | 1/20 | 0.34 |
| ▸ | CHUK | O15111 | 1/20 | 0.34 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | CDK4 | P11802 | 1/20 | 0.33 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.33 |
| ▸ | CCND1 | P24385 | 1/20 | 0.33 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL24105198 | 1.00 | PTK6 (0.41) | PTK6AURKBAURKABCL6KMT2A | |
| Hydrochloric Acid SCHEMBL25173779 | 0.99 | PTK6 (0.41) | PTK6AURKBAURKABCL6KMT2A | |
| SCHEMBL30167771 | 0.91 | PTK6 (0.40) | PTK6AURKBAURKABCL6KMT2A | |
| SCHEMBL24105243 | 0.91 | PTK6 (0.40) | PTK6AURKBAURKABCL6KMT2A | |
| SCHEMBL25447758 | 0.90 | AURKA (0.38) | PTK6AURKBAURKAMAPKAPK5KDM4E | |
| SCHEMBL25177003 | 0.90 | PTK6 (0.39) | PTK6AURKBAURKABCL6MAPKAPK5 | |
| SCHEMBL30167855 | 0.88 | PTK6 (0.38) | PTK6AURKBAURKAKMT2AMAPKAPK5 | |
| SCHEMBL24104694 | 0.88 | PTK6 (0.38) | PTK6AURKBAURKAKMT2AMAPKAPK5 | |
| SCHEMBL25170927 | 0.87 | TGM2 (0.43) | PTK6AURKBAURKAALDH1A1 | |
| SCHEMBL24105207 | 0.86 | IGF1R (0.37) | PTK6AURKBAURKAKMT2AERBB2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115667264-A | Novel imidazo-pyrazine derivatives | 豪夫迈·罗氏有限公司 | 2023-01-31 | — | — | CN | claimed |
| CN-115667264-A | Novel imidazo-pyrazine derivatives | 豪夫迈·罗氏有限公司 | 2023-01-31 | — | — | CN | disclosed |