Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL11841047 | 0.74 | TSHR (0.40) | TSHRTDP1 | |
| SCHEMBL1660527 | 0.72 | TSHR (0.36) | TSHRTDP1ALDH1A1 | |
| SCHEMBL5164634 | 0.70 | TSHR (0.33) | TSHRTDP1 | |
| SCHEMBL28925097 | 0.70 | — | — | |
| SCHEMBL28917891 | 0.69 | — | — | |
| SCHEMBL7882792 | 0.69 | — | — | |
| SCHEMBL1104685 | 0.69 | — | — | |
| SCHEMBL2326056 | 0.69 | — | — | |
| SCHEMBL28960696 | 0.69 | GRIK1 (0.32) | — | |
| SCHEMBL1657480 | 0.69 | TSHR (0.31) | TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-5149843-A | Chemical intermediate for antitumor-anticarcinogenic agents | MITSUBISHI KASEI CORPORATION (JP) | 1992-09-22 | — | — | US | disclosed |
| EP-0462616-A2 | Conjugated diene compounds, process for producing these compounds and use thereof | Mitsubishi Chemical Corporation (JP) | 1991-12-27 | — | — | EP | disclosed |