Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 2/20 | 0.65 |
| ▸ | HTT | P42858 | 1/20 | 0.65 |
| ▸ | RIPK1 | Q13546 | 3/20 | 0.55 |
| ▸ | GFER | P55789 | 1/20 | 0.54 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.52 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | AVPR1A | P37288 | 3/20 | 0.51 |
| ▸ | CCR5 | P51681 | 1/20 | 0.49 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.46 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.45 |
| ▸ | GABRP | O00591 | 1/20 | 0.45 |
| ▸ | GABRD | O14764 | 1/20 | 0.45 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.45 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.45 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8301611 | 0.79 | MAPK14 (1.00) | MAPK14HTTGFERHDAC1HDAC6 | |
| SCHEMBL28978282 | 0.79 | RIPK1 (0.83) | RIPK1ALDH1A1KMT2A | |
| SCHEMBL8710700 | 0.79 | AVPR1A (0.65) | MAPK14HTTGFERHDAC1HDAC6 | |
| SCHEMBL28978330 | 0.78 | RIPK1 (0.54) | RIPK1HDAC1HDAC6ALDH1A1MAPT | |
| SCHEMBL4068492 | 0.78 | RIPK1 (0.64) | RIPK1HDAC1HDAC6ALDH1A1KMT2A | |
| SCHEMBL28978310 | 0.75 | RIPK1 (0.69) | MAPK14RIPK1ALDH1A1MAPTHCRTR2 | |
| SCHEMBL8708574 | 0.74 | GFER (0.59) | MAPK14HTTGFERHDAC1HDAC6 | |
| SCHEMBL30289671 | 0.74 | MAPK14 (0.67) | MAPK14RIPK1MAPT | |
| SCHEMBL28978323 | 0.74 | MAPK14 (0.67) | MAPK14RIPK1MAPT | |
| SCHEMBL8710480 | 0.73 | GRIN2B (0.71) | MAPK14HTTGFERTPSAB1GABRA1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115894489-A | Inhibitor of receptor interaction protein kinase 1, preparation method and application thereof | 中国药科大学 | 2023-04-04 | — | — | CN | disclosed |