Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MTOR | P42345 | 1/20 | 0.32 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.31 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.31 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.31 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.31 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.31 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.31 |
| ▸ | TTK | P33981 | 1/20 | 0.31 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.31 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL30016058 | 0.90 | MTOR (0.36) | KDM1AKCNH2MTORCHRM4KDM4E | |
| SCHEMBL24699229 | 0.90 | MTOR (0.36) | KDM1AKCNH2MTORCHRM4KDM4E | |
| SCHEMBL30015974 | 0.88 | TDP1 (0.39) | MTORTDP1HRH3PDK1PDK2 | |
| SCHEMBL24699080 | 0.88 | TDP1 (0.39) | MTORTDP1HRH3PDK1PDK2 | |
| SCHEMBL24699256 | 0.85 | MEN1 (0.37) | ALDH1A1MTORCHRM4KDM4EHRH2 | |
| SCHEMBL30015914 | 0.85 | MAPK1 (0.41) | KDM1AALDH1A1MTORPSEN1PSEN2 | |
| SCHEMBL24699495 | 0.85 | MAPK1 (0.41) | KDM1AALDH1A1MTORPSEN1PSEN2 | |
| SCHEMBL30015825 | 0.83 | MTOR (0.35) | KDM1AKCNH2MTORCHRM4KDM4E | |
| SCHEMBL24699210 | 0.83 | MTOR (0.35) | KDM1AKCNH2MTORCHRM4KDM4E | |
| SCHEMBL24697976 | 0.81 | PI4KB (0.36) | KDM1AALDH1A1MTORTDP1KDM4E |
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-4313967-A1 | KHK INHIBITORS | GILEAD SCIENCES, INC. (US) | 2024-02-07 | — | — | EP | 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 |