Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | ABHD6 | Q9BV23 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28070928 | 0.80 | — | — | |
| SCHEMBL9828660 | 0.68 | HSD17B10 (0.39) | CYP3A4MAPTKDM4EALDH1A1TSHR | |
| SCHEMBL28209025 | 0.67 | MAPT (0.50) | CYP3A4MAPTCA1CA2CA7 | |
| SCHEMBL10793715 | 0.67 | PKM (0.38) | CYP3A4MAPTCA1CA2CA7 | |
| SCHEMBL16835958 | 0.66 | MAPT (0.43) | CYP3A4MAPTCA1CA2CA7 | |
| SCHEMBL11561345 | 0.65 | CYP3A4 (0.46) | CYP3A4MAPTCA1CA2CA7 | |
| SCHEMBL10710041 | 0.63 | MAPT (0.45) | CYP3A4MAPTPDE4DCA1CA2 | |
| SCHEMBL9781696 | 0.63 | CYP3A4 (0.45) | CYP3A4MAPTCA1CA2CA7 | |
| SCHEMBL25018315 | 0.62 | MAPT (0.43) | CYP3A4MAPTCA1CA2CA7 | |
| SCHEMBL7003958 | 0.61 | CYP3A4 (0.48) | CYP3A4MAPTKDM4ELMNAALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105814062-A | Spiro-oxazolones | 豪夫迈·罗氏有限公司 | 2016-07-27 | — | — | CN | disclosed |