Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 6/20 | 0.64 |
| ▸ | ACHE | P22303 | 2/20 | 0.64 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | DHODH | Q02127 | 1/20 | 0.40 |
| ▸ | LDHA | P00338 | 2/20 | 0.40 |
| ▸ | LDHB | P07195 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | G6PD | P11413 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL596184 | 0.87 | CYP3A4 (0.50) | CYP3A4ACHEMAPK1ALDH1A1KMT2A | |
| SCHEMBL15523819 | 0.84 | CA1 (0.50) | CYP3A4ACHEMAPK1ALDH1A1KMT2A | |
| SCHEMBL20561796 | 0.79 | CYP3A4 (0.68) | CYP3A4ACHEMAPK1ALDH1A1KMT2A | |
| Orsellinic Acid SCHEMBL522294 | 0.78 | CYP3A4 (1.00) | CYP3A4ACHEMAPK1ALDH1A1KMT2A | |
| SCHEMBL3469028 | 0.78 | CYP3A4 (0.69) | CYP3A4ACHEMAPK1ALDH1A1KMT2A | |
| SCHEMBL3835523 | 0.78 | CYP3A4 (0.42) | CYP3A4ACHEMAPK1ALDH1A1KMT2A | |
| SCHEMBL29803911 | 0.78 | CYP3A4 (0.42) | CYP3A4ACHEMAPK1ALDH1A1HSD17B10 | |
| SCHEMBL22060772 | 0.78 | CYP3A4 (0.42) | CYP3A4ACHEMAPK1ALDH1A1KMT2A | |
| SCHEMBL1727042 | 0.78 | CYP3A4 (0.42) | CYP3A4ACHEMAPK1ALDH1A1HSD17B10 | |
| SCHEMBL1104465 | 0.78 | ALDH1A1 (0.48) | CYP3A4ACHEMAPK1ALDH1A1HSD17B10 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4466260-A1 | COMPOUNDS AND THEIR USE IN TREATING CANCER | Astrazeneca AB (SE) | 2024-11-27 | — | — | EP | disclosed |
| CN-118574821-A | Compounds and their use in the treatment of cancer | 阿斯利康(瑞典)有限公司 | 2024-08-30 | — | — | CN | disclosed |
| WO-2023139199-A1 | COMPOUNDS AND THEIR USE IN TREATING CANCER | ASTRAZENECA AB (SE) | 2023-07-27 | — | — | WO | disclosed |
| WO-2023139199-A1 | COMPOUNDS AND THEIR USE IN TREATING CANCER | ASTRAZENECA AB (SE) | 2023-07-27 | — | — | WO | disclosed |