Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 5/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.36 |
| ▸ | NR3C2 | P08235 | 3/20 | 0.36 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.35 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.35 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | NSD2 | O96028 | 1/20 | 0.34 |
| ▸ | KDM1A | O60341 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.33 |
| ▸ | RORC | P51449 | 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 | |
|---|---|---|---|---|
| SCHEMBL24698160 | 1.00 | AR (0.36) | ARCYP11B2NR3C2PDK1PDK2 | |
| SCHEMBL24699037 | 0.88 | MTOR (0.44) | CYP11B2KDM1A | |
| SCHEMBL30016357 | 0.88 | MTOR (0.44) | CYP11B2KDM1A | |
| SCHEMBL30015914 | 0.86 | MAPK1 (0.41) | ARNR3C2KDM4EALDH1A1HPGD | |
| SCHEMBL24699495 | 0.86 | MAPK1 (0.41) | ARNR3C2KDM4EALDH1A1HPGD | |
| SCHEMBL24698161 | 0.84 | CYP11B2 (0.39) | ARCYP11B2KDM4EALDH1A1HPGD | |
| SCHEMBL30015825 | 0.82 | MTOR (0.35) | NR3C2KDM4EHPGDKDM1A | |
| SCHEMBL24698381 | 0.82 | MTOR (0.41) | ALDH1A1HPGDHRH3 | |
| SCHEMBL29134822 | 0.82 | MTOR (0.41) | ALDH1A1HPGDHRH3 | |
| SCHEMBL30014710 | 0.82 | MTOR (0.41) | ALDH1A1HPGDHRH3 |
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 2 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 |