Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | HMGCR | P04035 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4526343 | 0.86 | — | — | |
| SCHEMBL11286065 | 0.84 | TSHR (0.40) | ALDH1A1SMN1; SMN2HMGCR | |
| SCHEMBL7872938 | 0.82 | HMGCR (0.44) | ALDH1A1SMN1; SMN2HMGCR | |
| SCHEMBL10912609 | 0.80 | HMGCR (0.46) | ALDH1A1SMN1; SMN2HMGCR | |
| SCHEMBL31682154 | 0.80 | HMGCR (0.46) | ALDH1A1SMN1; SMN2HMGCR | |
| SCHEMBL4530368 | 0.78 | — | — | |
| SCHEMBL4518639 | 0.76 | — | — | |
| SCHEMBL11491307 | 0.76 | ALDH1A1 (0.31) | ALDH1A1 | |
| SCHEMBL4534677 | 0.75 | — | — | |
| SCHEMBL6137606 | 0.75 | HMGCR (0.46) | ALDH1A1SMN1; SMN2HMGCR |
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-7619125-B2 | Hydrogenation promoter, hydrogenation catalyst, and process for producing alkene compound | KANTO KAGAKU KABUSHIKI KAISHA (JP) | 2009-11-17 | — | — | US | disclosed |
| US-20080033221-A1 | Hydrogenation Promoter, Hydrogenation Catalyst, and Process for Producing Alkene Compound | NAGOYA INDUSTRIAL SCIENCE RESEARCH INSTITUTE (JP) | 2008-02-07 | — | — | US | disclosed |