Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL8047192 | 1.00 | ALDH1A1 (0.50) | ALDH1A1 | |
| SCHEMBL477010 | 1.00 | ALDH1A1 (0.50) | ALDH1A1 | |
| SCHEMBL30019809 | 1.00 | ALDH1A1 (0.50) | ALDH1A1 | |
| SCHEMBL123864 | 1.00 | — | — | |
| SCHEMBL1260534 | 1.00 | ALDH1A1 (0.50) | ALDH1A1 | |
| SCHEMBL477057 | 1.00 | — | — | |
| SCHEMBL477029 | 1.00 | ALDH1A1 (0.50) | ALDH1A1 | |
| SCHEMBL7770292 | 1.00 | ALDH1A1 (0.50) | ALDH1A1 | |
| SCHEMBL476999 | 1.00 | — | — | |
| SCHEMBL28032378 | 1.00 | ALDH1A1 (0.50) | ALDH1A1 |
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-2024046512-A2 | NITROGEN-CONTAINING MACROCYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF | 中国医药研究开发中心有限公司 | 2024-03-07 | — | — | WO | disclosed |