Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4370789 | 0.91 | ALDH1A1 (0.44) | ALDH1A1TP53CYP3A4 | |
| SCHEMBL2119578 | 0.89 | ALDH1A1 (0.38) | ALDH1A1TSHR | |
| SCHEMBL10681047 | 0.85 | ALDH1A1 (0.44) | ALDH1A1TSHRTP53CYP3A4 | |
| SCHEMBL25294218 | 0.84 | ALDH1A1 (0.39) | ALDH1A1 | |
| SCHEMBL5141190 | 0.83 | ALDH1A1 (0.50) | ALDH1A1TSHR | |
| SCHEMBL5430136 | 0.83 | ALDH1A1 (0.43) | ALDH1A1TSHRTP53CYP3A4 | |
| SCHEMBL4921148 | 0.83 | ALDH1A1 (0.61) | ALDH1A1TP53CYP3A4 | |
| SCHEMBL1685755 | 0.83 | TSHR (0.42) | ALDH1A1TSHR | |
| SCHEMBL6560347 | 0.81 | ALDH1A1 (0.37) | ALDH1A1 | |
| SCHEMBL15205122 | 0.81 | ALDH1A1 (0.41) | ALDH1A1TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-5078982-A | — | — | None | — | — | JP | disclosed |
| JP-H0578982-A | CELLULOSE FIBER-CONTAINING FIBER STRUCTURE AND ITS PRODUCTION | TOYOBO CO LTD | 1993-03-30 | — | — | JP | disclosed |
| JP-H00578982-A | — | — | 0001-01-01 | — | — | JP | disclosed |