Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 4/20 | 0.35 |
| ▸ | CA1 | P00915 | 4/20 | 0.35 |
| ▸ | CA2 | P00918 | 4/20 | 0.35 |
| ▸ | CA7 | P43166 | 4/20 | 0.35 |
| ▸ | CA9 | Q16790 | 4/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.35 |
| ▸ | RARA | P10276 | 1/20 | 0.33 |
| ▸ | RARB | P10826 | 1/20 | 0.33 |
| ▸ | ESRRG | P62508 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL8081657 | 1.00 | CA12 (0.35) | CA12CA1CA2CA7CA9 | |
| SCHEMBL8107463 | 0.96 | CA12 (0.36) | CA12CA1CA2CA7CA9 | |
| SCHEMBL8107467 | 0.96 | CA12 (0.36) | CA12CA1CA2CA7CA9 | |
| SCHEMBL8083855 | 0.89 | CA12 (0.33) | CA12CA1CA2CA7CA9 | |
| SCHEMBL8083853 | 0.89 | CA12 (0.33) | CA12CA1CA2CA7CA9 | |
| SCHEMBL8821926 | 0.89 | CA12 (0.36) | CA12CA1CA2CA7CA9 | |
| SCHEMBL9745293 | 0.89 | ALDH1A1 (0.40) | CA12CA1CA2CA7CA9 | |
| SCHEMBL9125115 | 0.89 | ALDH1A1 (0.40) | CA12CA1CA2CA7CA9 | |
| SCHEMBL8658793 | 0.86 | ESR1 (0.32) | — | |
| SCHEMBL8658790 | 0.86 | ESR1 (0.32) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0962445-B1 | Acetylene compound, liquid crystal composition and liquid crystal element | MITSUI CHEMICALS INC (JP) | 2003-02-26 | — | — | EP | disclosed |
| US-6217793-B1 | Acetylene compound, liquid crystal composition and liquid crystal element | MITSUI CHEMICALS, INC. (JP) | 2001-04-17 | — | — | US | disclosed |
| EP-0780456-B1 | Anti-ferroelectric liquid crystal compound and anti-ferroelectric liquid crystal composition | MITSUBISHI GAS CHEMICAL CO (JP) | 2000-10-11 | — | — | EP | disclosed |
| EP-0962445-A1 | Acetylene compound, liquid crystal composition and liquid crystal element | Mitsui Chemicals, Inc. (JP) | 1999-12-08 | — | — | EP | disclosed |
| US-5723069-A | Anti-ferroelectric liquid crystal compound and anti-ferroelectric liquid crystal composition | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 1998-03-03 | — | — | US | disclosed |
| EP-0780456-A1 | Anti-ferroelectric liquid crystal compound and anti-ferroelectric liquid crystal composition | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 1997-06-25 | — | — | EP | disclosed |