Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.37 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | OGG1 | O15527 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL29134732 | 0.86 | AKR1C1 (0.41) | AKR1C1HDAC1ALDH1A1HDAC3HDAC7 | |
| SCHEMBL2221 | 0.82 | AKR1C1 (0.55) | AKR1C1HDAC1ALDH1A1KMT2AMEN1 | |
| SCHEMBL29134935 | 0.81 | AKR1C1 (0.47) | AKR1C1HDAC1ALDH1A1HDAC3HDAC7 | |
| SCHEMBL3910628 | 0.80 | AKR1C1 (0.53) | AKR1C1HDAC1ALDH1A1KMT2AMEN1 | |
| Water SCHEMBL3910626 | 0.78 | AKR1C1 (0.52) | AKR1C1HDAC1ALDH1A1KMT2AMEN1 | |
| SCHEMBL1492737 | 0.78 | AKR1C1 (0.62) | AKR1C1HDAC1ALDH1A1HDAC4KMT2A | |
| SCHEMBL9966557 | 0.78 | AKR1C1 (0.68) | AKR1C1HDAC1ALDH1A1HDAC4KMT2A | |
| SCHEMBL12988917 | 0.77 | AKR1C1 (0.41) | AKR1C1HDAC1CES2CES1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL28915897 | 0.77 | AKR1C1 (0.66) | AKR1C1HDAC1ALDH1A1HDAC4KMT2A | |
| SCHEMBL2384832 | 0.77 | AKR1C1 (0.66) | AKR1C1HDAC1ALDH1A1HDAC4KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2025137640-A1 | AZASPIRO WRN INHIBITORS | GILEAD SCIENCES, INC. (US) | 2025-06-26 | — | — | WO | disclosed |
| EP-4313967-A1 | KHK INHIBITORS | GILEAD SCIENCES, INC. (US) | 2024-02-07 | — | — | EP | disclosed |
| CN-117120429-A | KHK inhibitor | 吉利德科学公司 | 2023-11-24 | — | — | CN | disclosed |
| WO-2022212194-A1 | KHK INHIBITORS | GILEAD SCIENCES, INC. (US) | 2022-10-06 | — | — | WO | disclosed |