Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| Toluene SCHEMBL3036821 | 0.88 | TSHR (0.50) | ALDH1A1CYP2A6TSHRACHETHRB | |
| O-Xylene SCHEMBL28248447 | 0.80 | TSHR (0.48) | ALDH1A1TSHRACHETHRBL3MBTL1 | |
| Water SCHEMBL11344535 | 0.80 | — | — | |
| SCHEMBL22628 | 0.80 | — | — | |
| Water SCHEMBL28254801 | 0.80 | TSHR (0.62) | ALDH1A1TSHRTDP1KMT2AMEN1 | |
| SCHEMBL28208107 | 0.80 | TSHR (0.62) | ALDH1A1TSHRTDP1KMT2AMEN1 | |
| Benzene SCHEMBL27516340 | 0.77 | TSHR (0.53) | ALDH1A1TSHRTDP1THRBL3MBTL1 | |
| Hydrochloric Acid SCHEMBL7224294 | 0.76 | — | — | |
| Ammonia Solution, Strong SCHEMBL28434463 | 0.76 | — | — | |
| SCHEMBL32674549 | 0.76 | — | — |
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-109715601-A | Diaza dialkenyl compound, film form the manufacturing method with raw material and film | 株式会社ADEKA | 2019-05-03 | — | — | CN | disclosed |