Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | THPO | P40225 | 1/20 | 0.32 |
| ▸ | GLO1 | Q04760 | 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 | |
|---|---|---|---|---|
| SCHEMBL28489497 | 0.78 | TDP1 (0.40) | TDP1ALDH1A1FFAR3TSHRTHPO | |
| SCHEMBL10639878 | 0.77 | ALDH1A1 (0.35) | TDP1ALDH1A1 | |
| SCHEMBL10639883 | 0.77 | ALDH1A1 (0.35) | TDP1ALDH1A1 | |
| SCHEMBL8649598 | 0.77 | — | — | |
| SCHEMBL27799178 | 0.77 | ALDH1A1 (0.53) | TDP1ALDH1A1FFAR3TSHR | |
| SCHEMBL12640274 | 0.77 | — | — | |
| SCHEMBL8649600 | 0.77 | — | — | |
| SCHEMBL19599277 | 0.74 | — | — | |
| SCHEMBL3143411 | 0.74 | — | — | |
| SCHEMBL265140 | 0.74 | — | — |
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-111807941-B | Method for synthesizing alpha-diketone compound by catalyzing with metal salt | 武汉理工大学 | 2022-07-05 | — | — | CN | disclosed |
| CN-111807941-A | Method for synthesizing alpha-diketone compound by catalyzing with metal salt | 武汉理工大学 | 2020-10-23 | — | — | CN | disclosed |