Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | NCK1 | P16333 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 2/20 | 0.43 |
| ▸ | LCK | P06239 | 5/20 | 0.42 |
| ▸ | BRAF | P15056 | 2/20 | 0.42 |
| ▸ | IKBKB | O14920 | 3/20 | 0.41 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 3/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.39 |
| ▸ | TEK | Q02763 | 1/20 | 0.39 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.39 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.39 |
| ▸ | JAK3 | P52333 | 1/20 | 0.39 |
| ▸ | CCNK | O75909 | 1/20 | 0.39 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 0.39 |
| ▸ | CDK7 | P50613 | 1/20 | 0.39 |
| ▸ | CCNH | P51946 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL24150522 | 0.85 | CYP1A2 (0.47) | CYP1A2ALDH1A1EGFRIKBKBRPS6KA3 | |
| SCHEMBL14724690 | 0.80 | LCK (0.39) | EGFRLCKBRAFKDRMAPK14 | |
| SCHEMBL1585490 | 0.80 | EGFR (0.44) | BACE1EGFRLCKBRAFKDR | |
| Hydrochloric Acid SCHEMBL5497021 | 0.79 | EGFR (0.43) | BACE1EGFRLCKBRAFKDR | |
| SCHEMBL15450886 | 0.78 | PIK3CA (0.54) | NCK1BACE1ALDH1A1BRAFCCNK | |
| SCHEMBL11741494 | 0.78 | NCK1 (0.41) | CYP1A2NCK1BACE1ALDH1A1RPS6KA3 | |
| SCHEMBL14724701 | 0.78 | CDK1 (0.52) | CYP1A2LCKBRAFRPS6KA3KDR | |
| SCHEMBL14457345 | 0.78 | MAPK14 (0.43) | BRAFRPS6KA3MAPK14 | |
| SCHEMBL25449364 | 0.77 | LCK (0.41) | EGFRLCKBRAFKDRMAPK14 | |
| SCHEMBL25097413 | 0.77 | BRAF (0.43) | EGFRLCKBRAF |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023025912-A1 | USE OF GCN2 INHIBITORS IN TREATING CANCER | Alesta Therapeutics BV (NL) | 2023-03-02 | — | — | WO | disclosed |
| EP-1836174-B1 | ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS | AMGEN INC (US) | 2013-02-27 | — | — | EP | disclosed |