Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NCF1 | P14598 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.30 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20376330 | 0.80 | NCF1 (0.37) | NCF1ALDH1A1 | |
| SCHEMBL10144661 | 0.80 | — | — | |
| SCHEMBL14393728 | 0.75 | — | — | |
| SCHEMBL13437768 | 0.73 | NCF1 (0.37) | NCF1ALDH1A1 | |
| SCHEMBL9062682 | 0.73 | NOS2 (0.42) | ALDH1A1 | |
| SCHEMBL804143 | 0.73 | SMN1; SMN2 (0.33) | NCF1ALDH1A1 | |
| SCHEMBL761339 | 0.73 | ALDH1A1 (0.45) | ALDH1A1 | |
| SCHEMBL19523734 | 0.73 | NCF1 (0.33) | NCF1ALDH1A1HRH4HRH3 | |
| SCHEMBL4031548 | 0.71 | NOS2 (0.32) | — | |
| SCHEMBL803894 | 0.71 | NOS2 (0.57) | NCF1ALDH1A1HRH4HRH3 |
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-2022083616-A1 | QUINAZOLINE COMPOUND AND PHARMACEUTICAL COMPOSITION THEREOF | 贝达药业股份有限公司 | 2022-04-28 | — | — | WO | disclosed |