Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP2 | O75604 | 12/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 12/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 11/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 10/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.62 |
| ▸ | MEN1 | O00255 | 3/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.61 |
| ▸ | TSHR | P16473 | 3/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.61 |
| ▸ | AR | P10275 | 1/20 | 0.60 |
| ▸ | HIF1A | Q16665 | 6/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | MGLL | Q99685 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL30576781 | 0.83 | CYP2C19 (0.84) | USP2CYP3A4CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL22804696 | 0.77 | CYP2C19 (0.57) | USP2CYP3A4CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL23439910 | 0.77 | CYP3A4 (0.67) | USP2CYP3A4CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL19159719 | 0.77 | MGLL (0.66) | USP2CYP3A4CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL23563319 | 0.75 | RIPK1 (0.51) | KMT2AHPGD | |
| SCHEMBL18423403 | 0.74 | MGLL (0.63) | USP2CYP3A4CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL6634283 | 0.73 | HSD11B1 (0.62) | USP2CYP3A4CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL22442348 | 0.72 | KDM4E (0.56) | USP2CYP3A4CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL16600265 | 0.72 | GPR183 (0.76) | — | |
| SCHEMBL16600267 | 0.72 | GPR183 (0.76) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3704121-A1 | DIAZASPIRO ROCK INHIBITORS | Bristol-Myers Squibb Company (US) | 2020-09-09 | — | — | EP | disclosed |