Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STAT3 | P40763 | 1/20 | 0.49 |
| ▸ | ACHE | P22303 | 3/20 | 0.48 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | TYR | P14679 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | GBA1 | P04062 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1299325 | 0.84 | TYR (0.52) | STAT3TYRCYP2C9 | |
| SCHEMBL19510640 | 0.83 | CYP1A2 (0.39) | ALOX5TYR | |
| SCHEMBL4208998 | 0.81 | STAT3 (0.36) | STAT3ACHEGRIA4TYRALDH1A1 | |
| SCHEMBL1151320 | 0.81 | HTT (0.39) | TYRALDH1A1CA2 | |
| SCHEMBL12894895 | 0.81 | ESR1 (0.53) | ALDH1A1TDP1SLC6A3CYP3A4CYP2C9 | |
| SCHEMBL11285215 | 0.81 | ADRB2 (0.45) | TYRTDP1SLC6A3CA2TSHR | |
| SCHEMBL14191123 | 0.80 | TAAR1 (0.52) | — | |
| SCHEMBL1256 | 0.80 | TAAR1 (0.52) | — | |
| SCHEMBL2838538 | 0.80 | TAAR1 (0.52) | — | |
| SCHEMBL28039437 | 0.79 | STAT3 (0.46) | STAT3ACHEGRIA4CYP2A6CHRNA7 |
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 |
|---|---|---|---|---|---|---|---|
| US-4355184-A | BY REACTING AN ALDEHYDE WITH AN ALKALI METAL SALT OF ACETOACETIC | NIPPON SODA COMPANY LIMITED (JP) | 1982-10-19 | — | — | US | disclosed |