Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 5/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.38 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.38 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.38 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.38 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.38 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | ABL1 | P00519 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL26188689 | 0.89 | CNR2 (0.41) | CNR2HTTMEN1KMT2AGAA | |
| SCHEMBL26188336 | 0.79 | HPGD (0.49) | HTTMEN1KMT2AGAAALDH1A1 | |
| SCHEMBL26188310 | 0.76 | HCRTR1 (0.40) | — | |
| SCHEMBL26188309 | 0.76 | ALDH1A1 (0.59) | HTTMEN1KMT2AGAAPTGDR2 | |
| SCHEMBL26188184 | 0.73 | HCRTR1 (0.42) | — | |
| SCHEMBL26188171 | 0.73 | HCRTR1 (0.34) | CNR2ABL1 | |
| Formaldehyde SCHEMBL28166410 | 0.65 | HPGD (0.40) | HTTMEN1KMT2AGAAPTGDR2 | |
| SCHEMBL4134865 | 0.64 | PTGDR2 (0.54) | MEN1KMT2APTGDR2ALDH1A1NPC1 | |
| SCHEMBL26188660 | 0.62 | HCRTR1 (0.64) | — | |
| SCHEMBL24696338 | 0.62 | HPGD (0.46) | CNR2HTTMEN1KMT2AGAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023160004-A1 | FUSED-RING COMPOUND HAVING ANALGESIC ACTIVITY, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 南京知和医药科技有限公司 | 2023-08-31 | — | — | WO | disclosed |