Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | NAAA | Q02083 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5607984 | 0.88 | NAAA (0.37) | THRBALDH1A1GLANAAA | |
| SCHEMBL5607434 | 0.86 | ALDH1A1 (0.46) | THRBALDH1A1GLANAAA | |
| SCHEMBL5608698 | 0.82 | ALDH1A1 (0.38) | ALDH1A1GLA | |
| SCHEMBL5607904 | 0.81 | ALDH1A1 (0.36) | THRBALDH1A1 | |
| SCHEMBL5608184 | 0.80 | NAAA (0.33) | NAAA | |
| SCHEMBL5608925 | 0.78 | THRB (0.42) | THRBALDH1A1GLANAAA | |
| SCHEMBL6561517 | 0.77 | — | — | |
| SCHEMBL5608427 | 0.77 | NAAA (0.33) | NAAA | |
| SCHEMBL6561521 | 0.76 | ALDH1A1 (0.33) | ALDH1A1 | |
| SCHEMBL5608715 | 0.75 | THRB (0.42) | THRBALDH1A1GLANAAA |
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 |