Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 5/20 | 0.45 |
| ▸ | KIF11 | P52732 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29946452 | 0.86 | KIF11 (0.42) | PKMKIF11LMNATHRBMAPT | |
| SCHEMBL29946515 | 0.86 | IDO1 (0.43) | PKMKIF11LMNATHRBMAPT | |
| SCHEMBL23078992 | 0.83 | PKM (0.46) | PKMKIF11LMNATHRBMAPT | |
| SCHEMBL29946475 | 0.83 | PKM (0.46) | PKMKIF11LMNATHRBMAPT | |
| SCHEMBL29946461 | 0.83 | KIF11 (0.51) | PKMKIF11LMNATHRBMAPT | |
| SCHEMBL29946501 | 0.79 | KIF11 (0.49) | PKMKIF11CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL2061739 | 0.77 | KIF11 (0.56) | PKMKIF11LMNAMAPTIDO1 | |
| SCHEMBL28956487 | 0.77 | KIF11 (0.55) | PKMKIF11MAPTCYP1A2CYP3A4 | |
| SCHEMBL29622007 | 0.74 | PGR (0.48) | LMNAMAPTCYP3A4CYP2C19PGR | |
| SCHEMBL27046251 | 0.74 | PARP10 (0.49) | — |
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-112442013-B | Compound serving as thyroid hormone beta receptor agonist and application thereof | 广东东阳光药业有限公司 | 2022-07-26 | — | — | CN | disclosed |