Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 4/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.42 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.42 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.41 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | CASP7 | P55210 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NEK2 | P51955 | 1/20 | 0.40 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.40 |
| ▸ | EHMT1 | Q9H9B1 | 1/20 | 0.40 |
| ▸ | GBA1 | P04062 | 1/20 | 0.40 |
| ▸ | DHFR | P00374 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL24698964 | 0.89 | MKNK1 (0.44) | KDM4EALDH1A1HPGDTP53GAA | |
| SCHEMBL24699484 | 0.86 | PDE7A (0.41) | KDM4EALDH1A1HPGDMKNK1MKNK2 | |
| SCHEMBL30015689 | 0.86 | PDE7A (0.41) | KDM4EALDH1A1HPGDMKNK1MKNK2 | |
| SCHEMBL24699356 | 0.85 | GBA1 (0.47) | KDM4EALDH1A1HPGDTP53GAA | |
| SCHEMBL24699459 | 0.84 | GBA1 (0.39) | KDM4EALDH1A1HPGDTP53GAA | |
| SCHEMBL24699476 | 0.84 | GBA1 (0.39) | KDM4EALDH1A1HPGDTP53GAA | |
| SCHEMBL24698767 | 0.82 | GBA1 (0.38) | KDM4EALDH1A1HPGDTP53GAA | |
| SCHEMBL24699054 | 0.81 | GBA1 (0.38) | KDM4EALDH1A1HPGDTP53GAA | |
| SCHEMBL24699497 | 0.80 | HSD17B10 (0.43) | KDM4EALDH1A1HPGDGAAHSD17B10 | |
| SCHEMBL24698066 | 0.79 | GBA1 (0.44) | KDM4EALDH1A1HPGDTP53GAA |
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 |