Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FYN | P06241 | 8/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.40 |
| ▸ | TUBB | P07437 | 1/20 | 0.40 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.40 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.40 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.40 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.40 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.40 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.40 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.40 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL6204421 | 0.87 | FYN (0.52) | FYNGAAACHEKDM4EALDH1A1 | |
| Ethyne SCHEMBL29254174 | 0.85 | FYN (0.50) | FYNGAAACHEKDM4EALDH1A1 | |
| SCHEMBL1697345 | 0.81 | FYN (0.47) | FYNGAAACHEKDM4EALDH1A1 | |
| Isopropylamine SCHEMBL9388040 | 0.79 | FYN (0.50) | FYNGAAACHEKDM4EALDH1A1 | |
| Acetic Acid SCHEMBL27522703 | 0.78 | TPMT (0.46) | FYNGAAACHEKDM4EALDH1A1 | |
| SCHEMBL6166522 | 0.76 | FYN (0.44) | FYNGAAKDM4EALDH1A1HPGD | |
| SCHEMBL721861 | 0.71 | ACHE (0.65) | FYNGAAACHEKDM4EALDH1A1 | |
| SCHEMBL17655664 | 0.71 | TRPA1 (0.48) | GAAACHEKDM4EALDH1A1HPGD | |
| SCHEMBL11528857 | 0.70 | TUBB4A (0.51) | FYNKDM4EALDH1A1HPGDMAPT | |
| Ethyl Acetate SCHEMBL27916288 | 0.70 | ALDH1A1 (0.48) | GAAKDM4EALDH1A1MAPTCA9 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100596294-C | 4'-substituted benzyloxy-phenyl butadiene derivatives and preparation and uses thereof | UNIV ZHEJIANG | 2010-03-31 | — | — | CN | claimed |
| CN-101161629-A | 4'-substituted benzyloxy-phenyl butadiene derivatives and preparation and uses thereof | UNIV ZHEJIANG (CN) | 2008-04-16 | — | — | CN | claimed |
| CN-100596294-C | 4'-substituted benzyloxy-phenyl butadiene derivatives and preparation and uses thereof | UNIV ZHEJIANG | 2010-03-31 | — | — | CN | disclosed |
| CN-101161629-A | 4'-substituted benzyloxy-phenyl butadiene derivatives and preparation and uses thereof | UNIV ZHEJIANG (CN) | 2008-04-16 | — | — | CN | disclosed |