Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.40 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 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 | |
|---|---|---|---|---|
| SCHEMBL465790 | 0.82 | CYP3A4 (0.47) | CYP3A4GABRA1GABRB2ALDH1A1TRPA1 | |
| SCHEMBL7762531 | 0.82 | CYP3A4 (0.47) | CYP3A4GABRA1GABRB2ALDH1A1TRPA1 | |
| SCHEMBL19891826 | 0.81 | CYP3A4 (0.47) | CYP3A4GABRA1GABRB2ALDH1A1TRPA1 | |
| SCHEMBL9918938 | 0.80 | CYP3A4 (0.66) | CYP3A4GABRA1GABRB2ALDH1A1TRPA1 | |
| SCHEMBL109280 | 0.80 | CYP3A4 (0.62) | CYP3A4GABRA1GABRB2ALDH1A1TRPA1 | |
| SCHEMBL18422183 | 0.78 | ALDH1A1 (0.43) | CYP3A4GABRA1GABRB2ALDH1A1 | |
| SCHEMBL28307637 | 0.76 | GABRA1 (0.35) | CYP3A4GABRA1GABRB2ALDH1A1TRPA1 | |
| SCHEMBL8964677 | 0.76 | CYP3A4 (0.54) | CYP3A4GABRA1GABRB2ALDH1A1TRPA1 | |
| SCHEMBL7209613 | 0.76 | CYP3A4 (0.42) | CYP3A4GABRA1GABRB2TRPA1 | |
| SCHEMBL10435654 | 0.75 | CYP3A4 (0.52) | CYP3A4GABRA1GABRB2ALDH1A1TRPA1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5213934-A | Core of colorant and binder grafted to polymeric shell | XEROX CORPORATION (US) | 1993-05-25 | — | — | US | claimed |
| EP-3135703-B1 | POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, OPTICAL MATERIAL, AND METHOD FOR PRODUCING OPTICAL MATERIAL | MITSUI CHEMICALS INC (JP) | 2019-10-16 | — | — | EP | disclosed |
| EP-3135703-A1 | POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, OPTICAL MATERIAL, AND METHOD FOR PRODUCING OPTICAL MATERIAL | Mitsui Chemicals, Inc. (JP) | 2017-03-01 | — | — | EP | disclosed |
| US-20170029553-A1 | POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIALS, OPTICAL MATERIAL, AND METHOD OF MANUFACTURING OPTICAL MATERIAL | MITSUI CHEMICALS, INC. (JP) | 2017-02-02 | — | — | US | disclosed |
| CN-106164124-A | The manufacture method of polymerizable composition for optical material, optical material and optical material | 三井化学株式会社 | 2016-11-23 | — | — | CN | disclosed |
| US-5213934-A | Core of colorant and binder grafted to polymeric shell | XEROX CORPORATION (US) | 1993-05-25 | — | — | US | disclosed |
| US-4552917-A | Modified polyurethane liquid polymer compositions | OLIN CORPORATION (US) | 1985-11-12 | — | — | US | disclosed |