Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | GLRA3 | O75311 | 1/20 | 0.39 |
| ▸ | GLRB | P48167 | 1/20 | 0.39 |
| ▸ | NR5A2 | O00482 | 1/20 | 0.36 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 4/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.34 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7720160 | 0.93 | CYP3A4 (0.54) | CYP3A4CYP2C9CYP2C19CYP1A2TSHR | |
| Methane SCHEMBL8854369 | 0.91 | CYP3A4 (0.52) | CYP3A4CYP2C9CYP2C19CYP1A2TSHR | |
| Hydrazine SCHEMBL28202215 | 0.90 | CYP3A4 (0.51) | CYP3A4CYP2C9CYP2C19CYP1A2TSHR | |
| SCHEMBL27658420 | 0.87 | AKR1C3 (0.35) | CYP3A4CYP2C9CYP2C19CYP1A2TSHR | |
| SCHEMBL28025527 | 0.84 | CYP3A4 (0.50) | CYP3A4CYP2C9CYP2C19CYP1A2TSHR | |
| E968 SCHEMBL30522296 | 0.83 | CYP3A4 (0.49) | CYP3A4CYP2C9CYP2C19CYP1A2TSHR | |
| SCHEMBL27993102 | 0.83 | CYP2C9 (0.52) | CYP3A4CYP2C9CYP2C19CYP1A2TSHR | |
| Allyl Alcohol SCHEMBL28219123 | 0.82 | CYP1A2 (0.48) | CYP3A4CYP2C9CYP2C19CYP1A2TSHR | |
| SCHEMBL27898975 | 0.82 | CYP2C9 (0.51) | CYP3A4CYP2C9CYP2C19CYP1A2TSHR | |
| SCHEMBL27949847 | 0.79 | CYP3A4 (0.49) | CYP3A4CYP2C9CYP2C19CYP1A2TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-105087110-B | Lubricant oil composite | 吉坤日矿日石能源株式会社 | 2018-04-27 | — | — | CN | disclosed |
| CN-105087111-B | Lubricant oil composite | 吉坤日矿日石能源株式会社 | 2018-03-13 | — | — | CN | disclosed |
| CN-105087112-A | Lubricating oil composition | JX NIPPON OIL & ENERGY CORP | 2015-11-25 | — | — | CN | disclosed |
| CN-105087110-A | Lubricating oil composition | JX NIPPON OIL & ENERGY CORP | 2015-11-25 | — | — | CN | disclosed |
| CN-105087111-A | Lubricant composition | JX NIPPON OIL & ENERGY CORP | 2015-11-25 | — | — | CN | disclosed |
| CN-105018189-A | Lubricating oil compound | JX NIPPON OIL & ENERGY CORP | 2015-11-04 | — | — | CN | disclosed |