Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAAA | Q02083 | 1/20 | 0.49 |
| ▸ | DGKA | P23743 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | PAM | P19021 | 2/20 | 0.45 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.43 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.43 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.42 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.42 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL20678516 | 0.89 | NAAA (0.52) | NAAATSHRALDH1A1LMNATP53 | |
| SCHEMBL810866 | 0.87 | ALDH1A1 (0.56) | NAAATSHRALDH1A1LMNATP53 | |
| SCHEMBL11153151 | 0.87 | ALDH1A1 (0.56) | NAAATSHRALDH1A1LMNATP53 | |
| SCHEMBL11499991 | 0.87 | ALDH1A1 (0.56) | NAAATSHRALDH1A1LMNATP53 | |
| SCHEMBL9657291 | 0.83 | ALDH1A1 (0.51) | NAAATSHRALDH1A1LMNATP53 | |
| SCHEMBL31581217 | 0.81 | ESR1 (0.58) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL11000432 | 0.80 | TSHR (0.63) | NAAATSHRALDH1A1LMNATP53 | |
| SCHEMBL11001210 | 0.80 | TSHR (0.63) | NAAATSHRALDH1A1LMNATP53 | |
| SCHEMBL11005721 | 0.80 | TSHR (0.63) | NAAATSHRALDH1A1LMNATP53 | |
| SCHEMBL11005756 | 0.80 | TSHR (0.63) | NAAATSHRALDH1A1LMNATP53 |
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 |
|---|---|---|---|---|---|---|---|
| CN-214765352-U | Trioctyl decyl trimellitate reaction kettle | 桐乡市舒乐橡塑材料股份有限公司 | 2021-11-19 | — | — | CN | claimed |