Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MGLL | Q99685 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28972581 | 0.92 | ALDH1A1 (0.59) | ALDH1A1TP53CYP3A4MGLL | |
| SCHEMBL1270657 | 0.89 | ALDH1A1 (0.47) | ALDH1A1TP53CYP3A4SMN1; SMN2 | |
| SCHEMBL28970845 | 0.86 | ALDH1A1 (0.53) | ALDH1A1TP53CYP3A4MGLLSMN1; SMN2 | |
| SCHEMBL11473802 | 0.83 | ALDH1A1 (0.45) | ALDH1A1TP53CYP3A4SMN1; SMN2 | |
| SCHEMBL4416081 | 0.82 | ALDH1A1 (0.65) | ALDH1A1TP53CYP3A4MGLL | |
| SCHEMBL147020 | 0.82 | ALDH1A1 (0.65) | ALDH1A1TP53CYP3A4MGLL | |
| Ether SCHEMBL19357308 | 0.82 | ALDH1A1 (0.56) | ALDH1A1TP53CYP3A4MGLLSMN1; SMN2 | |
| SCHEMBL1809471 | 0.81 | ALDH1A1 (0.59) | ALDH1A1TP53CYP3A4MGLLSMN1; SMN2 | |
| SCHEMBL7588647 | 0.81 | ALDH1A1 (0.48) | ALDH1A1TP53CYP3A4 | |
| SCHEMBL27670700 | 0.81 | ALDH1A1 (0.62) | ALDH1A1TP53CYP3A4MGLL |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108143634-B | Dental root surface protection material composition | 北京安泰生物医用材料有限公司 | 2021-02-19 | — | — | CN | claimed |
| CN-108143634-B | Dental root surface protection material composition | 北京安泰生物医用材料有限公司 | 2021-02-19 | — | — | CN | disclosed |