Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GBA1 | P04062 | 7/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | IGF1R | P08069 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | CASP7 | P55210 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | VCP | P55072 | 3/20 | 0.36 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.36 |
| ▸ | PDK2 | Q15119 | 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 | |
|---|---|---|---|---|
| SCHEMBL24699459 | 0.86 | GBA1 (0.39) | GBA1KDM4EALDH1A1GAAHPGD | |
| SCHEMBL24699476 | 0.86 | GBA1 (0.39) | GBA1KDM4EALDH1A1GAAHPGD | |
| SCHEMBL24699485 | 0.85 | KDM4E (0.42) | GBA1KDM4EALDH1A1GAAHPGD | |
| SCHEMBL30015382 | 0.85 | PDK1 (0.39) | GBA1KDM4EALDH1A1GAAHPGD | |
| SCHEMBL24699353 | 0.85 | PDK1 (0.39) | GBA1KDM4EALDH1A1GAAHPGD | |
| SCHEMBL24698767 | 0.83 | GBA1 (0.38) | GBA1KDM4EALDH1A1GAAHPGD | |
| SCHEMBL24699054 | 0.83 | GBA1 (0.38) | GBA1KDM4EALDH1A1GAAHPGD | |
| SCHEMBL24698964 | 0.83 | MKNK1 (0.44) | GBA1KDM4EALDH1A1GAAHPGD | |
| SCHEMBL24698066 | 0.82 | GBA1 (0.44) | GBA1KDM4EALDH1A1GAAHPGD | |
| SCHEMBL24698507 | 0.82 | GBA1 (0.42) | GBA1KDM4EALDH1A1GAAHPGD |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022212194-A1 | KHK INHIBITORS | GILEAD SCIENCES, INC. (US) | 2022-10-06 | — | — | WO | disclosed |