Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.45 |
| ▸ | PKM | P14618 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.39 |
| ▸ | ACACB | O00763 | 7/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL23959381 | 0.86 | ALDH1A1 (0.47) | PIK3CDALDH1A1HSP90AA1PKMMAPT | |
| SCHEMBL23930728 | 0.77 | PIK3CD (0.51) | PIK3CDALDH1A1HSP90AA1PKMMAPT | |
| SCHEMBL23930730 | 0.77 | PIK3CD (0.51) | PIK3CDALDH1A1HSP90AA1PKMMAPT | |
| SCHEMBL30194846 | 0.74 | PIK3CD (0.50) | PIK3CDALDH1A1HSP90AA1PKMMAPT | |
| SCHEMBL28478515 | 0.70 | ALDH1A1 (0.45) | PIK3CDALDH1A1HSP90AA1PKMMAPT | |
| SCHEMBL12448269 | 0.70 | HPGD (0.41) | PIK3CDALDH1A1MAPTHRH3POLB | |
| SCHEMBL25633502 | 0.70 | HPGD (0.41) | PIK3CDALDH1A1MAPTHRH3POLB | |
| SCHEMBL20009042 | 0.70 | PIK3CD (0.50) | PIK3CDALDH1A1HSP90AA1PKMMAPT | |
| SCHEMBL18035981 | 0.70 | MEN1 (0.34) | ALDH1A1MEN1KMT2A | |
| SCHEMBL18035978 | 0.70 | MEN1 (0.34) | ALDH1A1MEN1KMT2A |
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-2021214472-A1 | TETRAHYDROISOQUINOLINE COMPOUNDS AS NRF2 ACTIVATORS | C4X DISCOVERY LIMITED (GB) | 2021-10-28 | — | — | WO | disclosed |