Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.32 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.32 |
| ▸ | RARB | P10826 | 2/20 | 0.32 |
| ▸ | RARG | P13631 | 2/20 | 0.32 |
| ▸ | RXRA | P19793 | 2/20 | 0.32 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.32 |
| ▸ | RARA | P10276 | 1/20 | 0.32 |
| ▸ | SYK | P43405 | 1/20 | 0.31 |
| ▸ | AVPR1A | P37288 | 2/20 | 0.31 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.31 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL31474036 | 0.74 | SYK (0.35) | PKMALDH1A1KDM4EADRA1DADRA1A | |
| SCHEMBL31474080 | 0.74 | RXRA (0.42) | PKMALDH1A1HPGDTSHRHSD17B10 | |
| SCHEMBL24570280 | 0.74 | KDM4E (0.38) | PKMALDH1A1KDM4EHPGDTSHR | |
| SCHEMBL30514527 | 0.74 | KDM4E (0.38) | PKMALDH1A1KDM4EHPGDTSHR | |
| SCHEMBL522786 | 0.71 | CA12 (0.47) | ALDH1A1KDM4EHPGDTSHRHSD17B10 | |
| SCHEMBL31474132 | 0.69 | KDM4E (0.41) | PKMALDH1A1KDM4EHPGDTSHR | |
| SCHEMBL883735 | 0.69 | RAB9A (0.42) | PKMALDH1A1KDM4EHPGDTSHR | |
| SCHEMBL9887732 | 0.68 | PKM (0.41) | PKMALDH1A1KDM4EHPGDTSHR | |
| SCHEMBL31473996 | 0.68 | RARB (0.47) | PKMALDH1A1KDM4EHPGDTSHR | |
| SCHEMBL31474210 | 0.68 | IRAK4 (0.40) | PKMALDH1A1KDM4E |
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-2025061148-A1 | HETEROARYL COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF IN MEDICINE | 江苏恒瑞医药股份有限公司 | 2025-03-27 | — | — | WO | disclosed |