Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACLY | P53396 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | ACACB | O00763 | 1/20 | 0.31 |
| ▸ | ACACA | Q13085 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Formic Acid SCHEMBL9052109 | 0.83 | ACLY (0.40) | ACLYTSHRALDH1A1ACACBACACA | |
| SCHEMBL38932 | 0.83 | — | — | |
| SCHEMBL36074 | 0.83 | — | — | |
| SCHEMBL9186664 | 0.83 | MEN1 (0.35) | TSHRALDH1A1CYP2D6HIF1A | |
| SCHEMBL8664625 | 0.83 | TSHR (0.44) | ACLYTSHRALDH1A1ACACBACACA | |
| SCHEMBL1765014 | 0.80 | — | — | |
| Ethylene Glycol SCHEMBL7632620 | 0.80 | TSHR (0.42) | ACLYTSHRALDH1A1ACACBACACA | |
| Hydrochloric Acid SCHEMBL10884378 | 0.80 | — | — | |
| SCHEMBL7518615 | 0.80 | — | — | |
| SCHEMBL979789 | 0.80 | — | — |
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-115672200-A | Tubular reactor for preparing hydroxypivalaldehyde and application thereof | 万华化学集团股份有限公司 | 2023-02-03 | — | — | CN | disclosed |
| CN-108623437-B | Method for continuously producing neopentyl glycol | 利华益集团股份有限公司 | 2021-07-27 | — | — | CN | disclosed |