Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | ALB | P02768 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | APEX1 | P27695 | 1/20 | 0.41 |
| ▸ | PI4KA | P42356 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ADCY1 | Q08828 | 1/20 | 0.41 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.41 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.41 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL20624631 | 0.87 | BCHE (0.57) | BCHEALDH1A1MAPK1LMNAALB | |
| SCHEMBL22524135 | 0.87 | BCHE (0.57) | BCHEALDH1A1MAPK1LMNAALB | |
| SCHEMBL4745241 | 0.87 | BCHE (0.57) | BCHEALDH1A1MAPK1LMNAALB | |
| SCHEMBL23516968 | 0.87 | BCHE (0.57) | BCHEALDH1A1MAPK1LMNAALB | |
| SCHEMBL27574575 | 0.87 | BCHE (0.44) | BCHEALDH1A1MAPK1LMNAALB | |
| SCHEMBL23344693 | 0.86 | ALDH1A1 (0.46) | BCHEALDH1A1MAPK1LMNAALB | |
| SCHEMBL12567150 | 0.85 | BCHE (0.47) | BCHEALDH1A1MAPK1LMNAALB | |
| SCHEMBL23254277 | 0.85 | ALDH1A1 (0.60) | ALDH1A1MAPK1LMNAALBCYP2C19 | |
| SCHEMBL19147079 | 0.85 | ALDH1A1 (0.46) | BCHEALDH1A1MAPK1LMNAALB | |
| SCHEMBL12149460 | 0.85 | ALDH1A1 (0.60) | ALDH1A1MAPK1LMNAALBCYP2C19 |
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-2021178818-A2 | THERAPEUTIC AGENTS AND CONJUGATES THEREOF | BEIJING XUANYI PHARMASCIENCES CO., LTD. (CN) | 2021-09-10 | — | — | WO | disclosed |