Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20459492 | 0.77 | ALDH1A1 (0.39) | ALDH1A1TDP1CA2 | |
| SCHEMBL452691 | 0.73 | ALDH1A1 (0.38) | ALDH1A1TDP1CA2TSHR | |
| SCHEMBL18843424 | 0.73 | ALDH1A1 (0.33) | ALDH1A1TDP1CA2 | |
| SCHEMBL6055324 | 0.71 | ALDH1A1 (0.36) | ALDH1A1TDP1CA2TSHR | |
| SCHEMBL13220673 | 0.71 | — | — | |
| SCHEMBL21233021 | 0.71 | — | — | |
| SCHEMBL19823803 | 0.71 | — | — | |
| SCHEMBL204101 | 0.71 | ALDH1A1 (0.43) | ALDH1A1TDP1CA2TSHR | |
| SCHEMBL14350255 | 0.69 | ALDH1A1 (0.35) | ALDH1A1TDP1CA2TSHR | |
| SCHEMBL12748292 | 0.69 | ALDH1A1 (0.35) | ALDH1A1TDP1CA2TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019148851-A1 | FIVE-MEMBERED RING-SUBSTITUTED PYRIDAZINOL COMPOUND AND DERIVATIVES THEREOF, PREPARATION METHOD, HERBICIDAL COMPOSITION, AND APPLICATION | 青岛清原化合物有限公司 | 2019-08-08 | — | — | WO | disclosed |
| EP-2305772-B1 | COMPOSITION CONTAINING A METAL COMPLEX AND ORGANIC COMPOUND, AND LIGHT EMITTING ELEMENT USING SAID COMPOUND | SUMITOMO CHEMICAL CO (JP) | 2015-05-20 | — | — | EP | disclosed |