Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | ITK | Q08881 | 1/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.37 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.37 |
| ▸ | PRKACA | P17612 | 1/20 | 0.37 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.37 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.37 |
| ▸ | PRKD2 | Q9BZL6 | 1/20 | 0.37 |
| ▸ | EEF2K | O00418 | 1/20 | 0.36 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.36 |
| ▸ | CLK2 | P49760 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | PRKX | P51817 | 1/20 | 0.36 |
| ▸ | NEK4 | P51957 | 1/20 | 0.36 |
| ▸ | PRKG2 | Q13237 | 1/20 | 0.36 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.36 |
| ▸ | TAOK1 | Q7L7X3 | 1/20 | 0.36 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21961591 | 0.84 | ROCK2 (0.41) | EGFRITKROCK2ROCK1CHEK2 | |
| SCHEMBL21964275 | 0.82 | ROCK2 (0.36) | EGFRITKROCK2ROCK1CHEK2 | |
| SCHEMBL21961542 | 0.79 | PIK3CA (0.36) | EGFR | |
| SCHEMBL23485204 | 0.78 | BIRC2 (0.40) | — | |
| SCHEMBL29510701 | 0.78 | BIRC2 (0.40) | — | |
| SCHEMBL21961593 | 0.78 | BIRC2 (0.40) | — | |
| SCHEMBL31609633 | 0.78 | ELANE (0.41) | EGFRITKROCK2ROCK1CHEK2 | |
| SCHEMBL24552717 | 0.78 | ELANE (0.41) | EGFRITKROCK2ROCK1CHEK2 | |
| SCHEMBL21964510 | 0.78 | ROCK2 (0.39) | EGFRITKROCK2ROCK1CHEK2 | |
| SCHEMBL29510641 | 0.78 | ROCK2 (0.39) | EGFRITKROCK2ROCK1CHEK2 |
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-3643703-A1 | EP300/CREBBP INHIBITOR | Daiichi Sankyo Co., Ltd. (JP) | 2020-04-29 | — | — | EP | disclosed |
| WO-2019111980-A1 | CYCLOALKYLACETIC ACID-TYPE DIAMIDE DERIVATIVE | 第一三共株式会社 | 2019-06-13 | — | — | WO | disclosed |