Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA4 | P22748 | 1/20 | 0.44 |
| ▸ | CA6 | P23280 | 1/20 | 0.44 |
| ▸ | CA5A | P35218 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.44 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.44 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.41 |
| ▸ | FEN1 | P39748 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.41 |
| ▸ | KYNU | Q16719 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11198883 | 0.87 | ALDH1A1 (0.46) | ALDH1A1CA9GAASMN1; SMN2CYP2C9 | |
| SCHEMBL31732804 | 0.82 | GAA (0.52) | ALDH1A1CA9GAASMN1; SMN2CYP2C9 | |
| SCHEMBL375390 | 0.82 | GAA (0.52) | ALDH1A1CA9GAASMN1; SMN2CYP2C9 | |
| SCHEMBL11132562 | 0.78 | ALDH1A1 (0.53) | ALDH1A1GAASMN1; SMN2LMNAMAPT | |
| SCHEMBL27000244 | 0.78 | CA12 (0.61) | ALDH1A1CA9SMN1; SMN2CYP2C9CA12 | |
| SCHEMBL20025843 | 0.78 | SLC1A3 (0.55) | ALDH1A1CA9CYP2C9CA1CA2 | |
| SCHEMBL27388236 | 0.75 | ADAMTS4 (0.56) | ALDH1A1CA9GAACYP2C9CA12 | |
| SCHEMBL3971671 | 0.75 | SMN1; SMN2 (0.74) | ALDH1A1CA9SMN1; SMN2CYP2C9CA12 | |
| SCHEMBL4788424 | 0.75 | GAA (0.52) | ALDH1A1CA9GAACYP2C9CA12 | |
| SCHEMBL14094466 | 0.75 | CA1 (0.56) | ALDH1A1GAASMN1; SMN2CA1CA2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6323174-B1 | PERFUME COMPOSITION AT LEAST COMPRISING 4-METHYL-5-HEXEN-1-AL | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2001-11-27 | — | — | US | disclosed |
| US-6239324-B1 | REACTING A 1,3-BUTADIENE WITH OLEFIN IN PRESENCE OF HYDROPHILIC SOLVENT AND RUTHENIUM COMPOUND | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2001-05-29 | — | — | US | disclosed |