Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GNAI3 | P08754 | 5/20 | 0.48 |
| ▸ | GNAO1 | P09471 | 5/20 | 0.48 |
| ▸ | GNAI1 | P63096 | 5/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | LTA4H | P09960 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Heptane SCHEMBL28386128 | 1.00 | GNAI3 (0.48) | GNAI3GNAO1GNAI1TSHRTHRB | |
| Octane SCHEMBL28866492 | 0.97 | GNAI3 (0.47) | GNAI3GNAO1GNAI1TSHRTHRB | |
| Octane SCHEMBL28267212 | 0.97 | GNAI3 (0.47) | GNAI3GNAO1GNAI1TSHRTHRB | |
| Heptane SCHEMBL23198377 | 0.97 | GNAI3 (0.47) | GNAI3GNAO1GNAI1TSHRTHRB | |
| Heptane SCHEMBL28257646 | 0.97 | GNAI3 (0.47) | GNAI3GNAO1GNAI1TSHRTHRB | |
| Hexane SCHEMBL28377092 | 0.97 | GNAI3 (0.45) | GNAI3GNAO1GNAI1TSHRTHRB | |
| Heptane SCHEMBL23198384 | 0.95 | GNAI3 (0.45) | GNAI3GNAO1GNAI1TSHRTHRB | |
| N-Methylpiperidine SCHEMBL20503132 | 0.94 | L3MBTL1 (0.46) | GNAI3GNAO1GNAI1TSHRTHRB | |
| Hexane SCHEMBL28381606 | 0.94 | GNAI3 (0.43) | GNAI3GNAO1GNAI1TSHRTHRB | |
| Hexane SCHEMBL28546568 | 0.94 | GNAI3 (0.43) | GNAI3GNAO1GNAI1TSHRTHRB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109046444-B | Bifunctional catalyst for C8 arene isomerization and preparation method thereof | 中触媒新材料股份有限公司 | 2021-03-02 | — | — | CN | disclosed |
| CN-108862314-B | Hierarchical-pore wide-silica-alumina-ratio EUO-structure molecular sieve and synthesis method thereof | 中触媒新材料股份有限公司 | 2020-04-03 | — | — | CN | disclosed |