Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.46 |
| ▸ | CRBN | Q96SW2 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAP1LC3B | Q9GZQ8 | 1/20 | 0.31 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.31 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL19047109 | 0.84 | MAP3K14 (0.60) | MAP3K14CRBNMAPTALDH1A1 | |
| SCHEMBL2380603 | 0.78 | ALDH1A1 (0.38) | MAP3K14MAPTALDH1A1KMT2A | |
| SCHEMBL427737 | 0.76 | ALDH1A1 (0.47) | MAPTALDH1A1MAP1LC3BSLC18A3KMT2A | |
| SCHEMBL7217095 | 0.75 | ALDH1A1 (0.40) | MAP3K14MAPTALDH1A1KMT2A | |
| SCHEMBL11384807 | 0.75 | MAP3K14 (0.52) | MAP3K14CRBNMAPTKMT2A | |
| SCHEMBL11384813 | 0.75 | MAP3K14 (0.52) | MAP3K14CRBNMAPTKMT2A | |
| SCHEMBL11728785 | 0.75 | MAPT (0.39) | MAP3K14CRBNMAPTALDH1A1KMT2A | |
| SCHEMBL11719476 | 0.75 | MAP3K14 (0.46) | MAP3K14CRBNMAPTALDH1A1KMT2A | |
| SCHEMBL427801 | 0.73 | ALDH1A1 (0.50) | MAPTALDH1A1MAP1LC3BSLC18A3KMT2A | |
| SCHEMBL5471447 | 0.72 | ALDH1A1 (0.42) | MAPTALDH1A1MAP1LC3BSLC18A3KMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112592289-B | Preparation method of gabapentin intermediate | 内蒙古永太化学有限公司 | 2022-09-20 | — | — | CN | claimed |
| CN-112592289-A | Preparation method of gabapentin intermediate | 内蒙古永太化学有限公司 | 2021-04-02 | — | — | CN | claimed |
| CN-112592289-B | Preparation method of gabapentin intermediate | 内蒙古永太化学有限公司 | 2022-09-20 | — | — | CN | disclosed |
| CN-112592289-A | Preparation method of gabapentin intermediate | 内蒙古永太化学有限公司 | 2021-04-02 | — | — | CN | disclosed |