Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL28350058 | 0.77 | ALDH1A1 (0.35) | ALDH1A1L3MBTL1TSHR | |
| SCHEMBL5014569 | 0.72 | ALDH1A1 (0.30) | ALDH1A1L3MBTL1 | |
| SCHEMBL5022657 | 0.70 | — | — | |
| SCHEMBL27436534 | 0.70 | — | — | |
| SCHEMBL6724635 | 0.69 | — | — | |
| SCHEMBL28655493 | 0.69 | ALDH1A1 (0.30) | ALDH1A1 | |
| SCHEMBL5161200 | 0.67 | CYP2D6 (0.41) | ALDH1A1TP53TSHR | |
| SCHEMBL8957724 | 0.67 | ALDH1A1 (0.30) | ALDH1A1L3MBTL1 | |
| SCHEMBL781032 | 0.67 | ALDH1A1 (0.32) | ALDH1A1L3MBTL1TSHR | |
| SCHEMBL27530923 | 0.67 | — | — |
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-113321601-A | Fluorosurfactants | 默克专利股份有限公司 | 2021-08-31 | — | — | CN | disclosed |