Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GBA1 | P04062 | 1/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | CA2 | P00918 | 7/20 | 0.56 |
| ▸ | CA9 | Q16790 | 5/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | CA12 | O43570 | 2/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.55 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.55 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.55 |
| ▸ | CA1 | P00915 | 6/20 | 0.54 |
| ▸ | CA7 | P43166 | 2/20 | 0.54 |
| ▸ | MMP2 | P08253 | 4/20 | 0.53 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.53 |
| ▸ | MMP9 | P14780 | 4/20 | 0.50 |
| ▸ | MMP1 | P03956 | 3/20 | 0.50 |
| ▸ | MMP13 | P45452 | 3/20 | 0.50 |
| ▸ | MMP8 | P22894 | 2/20 | 0.50 |
| ▸ | MMP3 | P08254 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL6435458 | 0.93 | ALDH1A1 (0.55) | GBA1GAASMN1; SMN2CA2CA9 | |
| SCHEMBL25650178 | 0.88 | GAA (0.65) | GBA1GAASMN1; SMN2CA2CA9 | |
| SCHEMBL3415855 | 0.85 | GBA1 (0.61) | GBA1GAASMN1; SMN2CA2CA9 | |
| SCHEMBL10289397 | 0.85 | CA2 (0.62) | GBA1GAASMN1; SMN2CA2CA9 | |
| SCHEMBL7872813 | 0.83 | SMN1; SMN2 (0.54) | GBA1SMN1; SMN2CA2CA9ALDH1A1 | |
| SCHEMBL30613610 | 0.81 | MMP2 (0.57) | GBA1GAASMN1; SMN2CA2CA9 | |
| SCHEMBL6500063 | 0.80 | CA2 (0.62) | GBA1GAASMN1; SMN2CA2CA9 | |
| SCHEMBL19165633 | 0.77 | GAA (0.52) | GBA1GAASMN1; SMN2CA2CA9 | |
| SCHEMBL19165392 | 0.77 | GAA (0.52) | GBA1GAASMN1; SMN2CA2CA9 | |
| SCHEMBL15705231 | 0.77 | SLC1A3 (0.55) | GBA1GAASMN1; SMN2CA2CA9 |
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 |