Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.94 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.94 |
| ▸ | TP53 | P04637 | 3/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.48 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.48 |
| ▸ | RELA | Q04206 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.47 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | DPP4 | P27487 | 1/20 | 0.41 |
| ▸ | CRHBP | P24387 | 1/20 | 0.41 |
| ▸ | CRHR2 | Q13324 | 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 | |
|---|---|---|---|---|
| SCHEMBL30451936 | 0.97 | ALDH1A1 (1.00) | ALDH1A1MAPK1TP53RAB9AMAPT | |
| SCHEMBL115115 | 0.97 | ALDH1A1 (1.00) | ALDH1A1MAPK1TP53RAB9AMAPT | |
| Hydrochloric Acid SCHEMBL28530945 | 0.94 | ALDH1A1 (0.94) | ALDH1A1MAPK1TP53RAB9AMAPT | |
| SCHEMBL27649307 | 0.94 | ALDH1A1 (0.94) | ALDH1A1MAPK1TP53RAB9AMAPT | |
| SCHEMBL1270894 | 0.94 | ALDH1A1 (0.94) | ALDH1A1MAPK1TP53RAB9AMAPT | |
| SCHEMBL29213644 | 0.94 | ALDH1A1 (0.94) | ALDH1A1MAPK1TP53RAB9AMAPT | |
| Water SCHEMBL2802174 | 0.94 | ALDH1A1 (0.94) | ALDH1A1MAPK1TP53RAB9AMAPT | |
| Methane SCHEMBL10434104 | 0.94 | ALDH1A1 (0.94) | ALDH1A1MAPK1TP53RAB9AMAPT | |
| Water SCHEMBL3058934 | 0.94 | ALDH1A1 (0.94) | ALDH1A1MAPK1TP53RAB9AMAPT | |
| Ethylene SCHEMBL29018894 | 0.92 | ALDH1A1 (0.90) | ALDH1A1MAPK1TP53RAB9AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-118290227-A | Preparation method of 4-bromohexabenzotricyclo [4.4.4.0] tetradecane | 维思普新材料（苏州）有限公司 | 2024-07-05 | — | — | CN | disclosed |