Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | SHBG | P04278 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | ADH1A | P07327 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA4 | P22748 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5605998 | 0.90 | CYP1A2 (0.39) | CYP1A2SHBGCHRM2CYP2D6CHRM1 | |
| SCHEMBL28259395 | 0.87 | CYP1A2 (0.34) | CYP1A2 | |
| SCHEMBL27910012 | 0.81 | ADH1A (0.35) | CYP1A2ADH1A | |
| SCHEMBL29102614 | 0.79 | SIGMAR1 (0.39) | CYP1A2 | |
| SCHEMBL6318304 | 0.78 | CYP1A2 (0.40) | CYP1A2SHBGCHRM2CYP2D6CHRM1 | |
| SCHEMBL10779865 | 0.78 | CYP1A2 (0.40) | CYP1A2SHBGCHRM2CYP2D6CHRM1 | |
| SCHEMBL12504404 | 0.77 | NAAA (0.36) | — | |
| SCHEMBL10942478 | 0.77 | CYP1A2 (0.41) | CYP1A2SHBGCHRM2CYP2D6CHRM1 | |
| SCHEMBL7526068 | 0.77 | CYP1A2 (0.41) | CYP1A2SHBGCHRM2CYP2D6CHRM1 | |
| SCHEMBL16933912 | 0.77 | CYP1A2 (0.41) | CYP1A2SHBGCHRM2CYP2D6CHRM1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0727473-B1 | Liquid crystaline alkynyltolan compound, liquid crystal composition and liquid crystal display element | CHISSO CORP (JP) | 2000-01-12 | — | — | EP | disclosed |