Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH2 | P25021 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | EEF2K | O00418 | 3/20 | 0.39 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.39 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.39 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.38 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | RECQL | P46063 | 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 | |
|---|---|---|---|---|
| SCHEMBL29134766 | 0.80 | MAP4K4 (0.34) | MAP4K4MAP2K4MKNK1MKNK2RAB9A | |
| SCHEMBL24699540 | 0.80 | HRH2 (0.38) | HRH2HRH3ALDH1A1EEF2KMAP2K4 | |
| SCHEMBL24698066 | 0.79 | GBA1 (0.44) | HRH2HRH3ALDH1A1EEF2KHTT | |
| SCHEMBL24698078 | 0.79 | GBA1 (0.47) | HRH2HRH3ALDH1A1KDM4EGAA | |
| SCHEMBL24698533 | 0.78 | GBA1 (0.46) | ALDH1A1EEF2KKDM4EGAATDP1 | |
| SCHEMBL24698075 | 0.78 | ALDH1A1 (0.37) | HRH2HRH3ALDH1A1EEF2KMAP2K4 | |
| SCHEMBL9558730 | 0.78 | KDM4E (0.48) | HRH2HRH3ALDH1A1KDM4ERAB9A | |
| SCHEMBL4134361 | 0.77 | ALDH1A1 (0.52) | HRH2HRH3ALDH1A1KDM4ECYP1A2 | |
| SCHEMBL24698868 | 0.76 | PDE2A (0.38) | HRH2HRH3ALDH1A1NPSR1EEF2K | |
| SCHEMBL24699076 | 0.75 | KDM4E (0.50) | ALDH1A1HTTKDM4EPOLBHPGD |
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-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 |
| WO-2022212194-A1 | KHK INHIBITORS | GILEAD SCIENCES, INC. (US) | 2022-10-06 | — | — | WO | disclosed |