Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGKA | P23743 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.52 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.52 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.52 |
| ▸ | PAM | P19021 | 2/20 | 0.51 |
| ▸ | NAAA | Q02083 | 1/20 | 0.51 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.51 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.51 |
| ▸ | HTR2C | P28335 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | PPARG | P37231 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Toluene SCHEMBL4749551 | 0.90 | CYP4F2 (0.55) | DGKATSHRALDH1A1PAM | |
| Toluene SCHEMBL6270207 | 0.90 | CYP4F2 (0.55) | DGKATSHRALDH1A1PAM | |
| Toluene SCHEMBL10334155 | 0.90 | DGKA (0.51) | DGKATSHRLMNAALDH1A1CYP3A4 | |
| O-Xylene SCHEMBL31519872 | 0.89 | DGKA (0.62) | DGKATSHRLMNAALDH1A1TP53 | |
| Benzene SCHEMBL9957260 | 0.88 | DGKA (0.77) | DGKATSHRLMNAALDH1A1PRSS1 | |
| Benzene SCHEMBL11441206 | 0.88 | DGKA (0.77) | DGKATSHRLMNAALDH1A1PRSS1 | |
| Toluene SCHEMBL9169396 | 0.88 | DGKA (0.48) | DGKATSHRLMNAALDH1A1TP53 | |
| P-Xylene SCHEMBL6536586 | 0.87 | DGKA (0.75) | DGKATSHRLMNAALDH1A1PRSS1 | |
| P-Xylene SCHEMBL15987887 | 0.87 | DGKA (0.75) | DGKATSHRLMNAALDH1A1PRSS1 | |
| Ethylene Glycol Dioctanoate SCHEMBL15987600 | 0.87 | DGKA (0.75) | DGKATSHRLMNAALDH1A1PRSS1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109694323-A | The synthetic method of organic drug intermediate dioctyl adipate | 张欣 | 2019-04-30 | — | — | CN | claimed |
| CN-109694323-A | The synthetic method of organic drug intermediate dioctyl adipate | 张欣 | 2019-04-30 | — | — | CN | disclosed |
| CN-109694323-A | The synthetic method of organic drug intermediate dioctyl adipate | 张欣 | 2019-04-30 | — | — | CN | disclosed |