Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | PKM | P14618 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.32 |
| ▸ | MGAM | O43451 | 1/20 | 0.32 |
| ▸ | SI | P14410 | 1/20 | 0.32 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | PTPRB | P23467 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ELANE | P08246 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL808737 | 0.88 | MEN1 (0.38) | ALDH1A1PKMMEN1KMT2ATHRB | |
| SCHEMBL13606393 | 0.87 | ATM (0.39) | ALDH1A1PKMMEN1KMT2ATHRB | |
| SCHEMBL18346585 | 0.86 | ALDH1A1 (0.37) | ALDH1A1PKMMEN1KMT2ATHRB | |
| SCHEMBL4901424 | 0.83 | ALDH1A1 (0.38) | ALDH1A1PKMMEN1KMT2ATHRB | |
| SCHEMBL16450968 | 0.83 | MEN1 (0.39) | MEN1KMT2A | |
| SCHEMBL32679949 | 0.83 | MAPT (0.38) | MAPTPOLB | |
| SCHEMBL28871790 | 0.82 | PTPN1 (0.37) | ALDH1A1MEN1KMT2AMAPTATM | |
| SCHEMBL29067495 | 0.80 | EPHX1 (0.36) | ALDH1A1PKMMEN1KMT2ATHRB | |
| SCHEMBL8053447 | 0.80 | MEN1 (0.50) | ALDH1A1PKMMEN1KMT2ATHRB | |
| SCHEMBL17617155 | 0.79 | ALDH1A1 (0.33) | ALDH1A1PKMMEN1KMT2ATHRB |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117069561-B | Preparation method of 2-ethyl valeric acid | 湖南省湘中制药有限公司 | 2024-05-31 | — | — | CN | disclosed |
| CN-116947600-B | Preparation method of 2-isopropyl valeric acid as valproic acid process impurity | 湖南省湘中制药有限公司 | 2024-04-26 | — | — | CN | disclosed |
| CN-116874347-B | Preparation method of impurity dipropylvaleric acid in valproic acid process | 湖南省湘中制药有限公司 | 2024-03-29 | — | — | CN | disclosed |
| CN-117069561-A | Preparation method of 2-ethyl valeric acid | 湖南省湘中制药有限公司 | 2023-11-17 | — | — | CN | disclosed |
| CN-116947600-A | Preparation method of 2-isopropyl valeric acid as valproic acid process impurity | 湖南省湘中制药有限公司 | 2023-10-27 | — | — | CN | disclosed |
| CN-116874347-A | Preparation method of impurity dipropylvaleric acid in valproic acid process | 湖南省湘中制药有限公司 | 2023-10-13 | — | — | CN | disclosed |
| US-5101070-A | From an acetoacetic acid ester; by-product minimization | NIPPON GOHSEI KAGAKU KOGYO KABUSHIKI KAISHA (JP) | 1992-03-31 | — | — | US | disclosed |