Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | HTR1D | P28221 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | CTSK | P43235 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | MYC | P01106 | 1/20 | 0.38 |
| ▸ | WDR5 | P61964 | 1/20 | 0.38 |
| ▸ | USP8 | P40818 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7656086 | 0.89 | CTSK (0.45) | ALDH1A1KMT2AMEN1CTSKKDM4E | |
| SCHEMBL7652516 | 0.82 | CTSK (0.46) | ALDH1A1KMT2AMEN1CTSKKDM4E | |
| Dimethylamine SCHEMBL7679157 | 0.81 | ALDH1A1 (0.48) | ALDH1A1L3MBTL1KMT2AMAPTMEN1 | |
| SCHEMBL7652922 | 0.80 | CTSK (0.50) | ALDH1A1L3MBTL1KMT2AMEN1CTSK | |
| SCHEMBL7682175 | 0.80 | ALDH1A1 (0.55) | ALDH1A1L3MBTL1KMT2AMAPTMEN1 | |
| SCHEMBL7649212 | 0.79 | CTSK (0.47) | ALDH1A1KMT2AMAPTMEN1CTSK | |
| SCHEMBL7656565 | 0.79 | ROCK2 (0.48) | ALDH1A1L3MBTL1CTSKADORA3POLB | |
| SCHEMBL7652478 | 0.78 | CTSK (0.48) | MAPTCTSKADORA3ROCK2 | |
| SCHEMBL7652889 | 0.77 | CTSK (0.45) | ALDH1A1NPSR1MAPTCTSKKDM4E | |
| SCHEMBL7652938 | 0.76 | ALDH1A1 (0.43) | ALDH1A1KMT2AMAPTMEN1CTSK |
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-6492407-B2 | NEUROPROTECTIVE ACTIVITY | BOEHRINGER IMGELHEIM PHARMA KG (DE) | 2002-12-10 | — | — | US | disclosed |