Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | NCK1 | P16333 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.41 |
| ▸ | ACHE | P22303 | 6/20 | 0.39 |
| ▸ | BCHE | P06276 | 4/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.39 |
| ▸ | GRIN2A | Q12879 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8286180 | 1.00 | TDP1 (0.41) | TDP1ALOX15CYP3A4TP53THRB | |
| SCHEMBL8286198 | 0.84 | ALDH1A1 (0.46) | TDP1ALOX15CYP3A4TP53THRB | |
| SCHEMBL8404562 | 0.79 | CYP1A2 (0.52) | TDP1SMN1; SMN2ALDH1A1HSD17B10LMNA | |
| SCHEMBL31509997 | 0.76 | IMPDH2 (0.47) | TDP1ALOX15CYP3A4TP53SMN1; SMN2 | |
| SCHEMBL30702097 | 0.76 | BACE1 (0.41) | TDP1CYP3A4ALDH1A1LMNABACE1 | |
| SCHEMBL17981072 | 0.76 | CYP1A2 (0.41) | TDP1ALDH1A1HSD17B10LMNANCK1 | |
| SCHEMBL12114723 | 0.76 | TRPA1 (0.46) | TDP1ALOX15TP53SMN1; SMN2ALDH1A1 | |
| SCHEMBL19705388 | 0.76 | CYP1A2 (0.41) | TDP1SMN1; SMN2ALDH1A1HSD17B10LMNA | |
| SCHEMBL5987050 | 0.76 | CYP1A2 (0.41) | TDP1LMNANCK1BACE1CYP1A2 | |
| SCHEMBL29923537 | 0.76 | CYP1A2 (0.41) | TDP1ALDH1A1HSD17B10LMNANCK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4565574-A1 | SARS-COV2 MAIN PROTEASE INHIBITORS | GILEAD SCIENCES, INC. (US) | 2025-06-11 | — | — | EP | disclosed |
| CN-119731159-A | SARS-CoV2 main proteinase inhibitor | 吉利德科学公司 | 2025-03-28 | — | — | CN | disclosed |
| WO-2024031089-A1 | SARS-COV2 MAIN PROTEASE INHIBITORS | GILEAD SCIENCES, INC. (US) | 2024-02-08 | — | — | WO | disclosed |