Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM1 | Q13255 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | EP300 | Q09472 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | CREBBP | Q92793 | 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 | |
|---|---|---|---|---|
| SCHEMBL11062782 | 0.85 | ALDH1A1 (0.37) | ALDH1A1TSHREP300HIF1ACREBBP | |
| SCHEMBL5607904 | 0.81 | ALDH1A1 (0.36) | ALDH1A1EP300HIF1ACREBBP | |
| SCHEMBL5607821 | 0.76 | ALDH1A1 (0.30) | ALDH1A1TSHR | |
| SCHEMBL1734908 | 0.75 | ALDH1A1 (0.37) | GRM1ALDH1A1TSHR | |
| SCHEMBL5607877 | 0.75 | ALDH1A1 (0.49) | ALDH1A1 | |
| SCHEMBL5608491 | 0.74 | — | — | |
| SCHEMBL22234943 | 0.73 | GRM1 (0.38) | GRM1 | |
| SCHEMBL5608899 | 0.71 | ALDH1A1 (0.30) | ALDH1A1TSHR | |
| SCHEMBL16039163 | 0.71 | ALDH1A1 (0.30) | ALDH1A1TSHR | |
| SCHEMBL5607557 | 0.70 | EP300 (0.35) | EP300HIF1ACREBBP |
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 |
|---|---|---|---|---|---|---|---|
| US-RE39744-E1 | Adamantane derivatives and process for producing them | DAICEL CHEMICAL INDUSTRIES, LTD. (JP) | 2007-07-24 | — | — | US | disclosed |
| US-6392104-B1 | CHEMICAL INTERMEDIATES FOR DRUGS, AGRICULTURE | DAICEL CHEMICAL INDUSTRIES, LTD. (JP) | 2002-05-21 | — | — | US | disclosed |
| EP-0927711-A1 | ADAMANTANE DERIVATIVES AND PROCESS FOR PRODUCING THEM | Daicel Chemical Industries, Ltd. (JP) | 1999-07-07 | — | — | EP | disclosed |