Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 5/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | PLAU | P00749 | 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 | |
|---|---|---|---|---|
| SCHEMBL28852779 | 1.00 | CYP2C9 (0.35) | CYP2C9CYP2D6MEN1KMT2APOLB | |
| SCHEMBL14917059 | 0.75 | PLAU (0.54) | CYP2C9CYP2D6CYP3A4PLAU | |
| SCHEMBL14927124 | 0.75 | PLAU (0.54) | CYP2C9CYP2D6CYP3A4PLAU | |
| SCHEMBL31330161 | 0.71 | ALDH1A1 (0.35) | CYP2C9CYP2D6CYP3A4 | |
| SCHEMBL31329947 | 0.69 | CYP2C9 (0.39) | CYP2C9CYP2D6GAACYP3A4 | |
| SCHEMBL24387226 | 0.68 | PLAU (0.54) | CYP2C9CYP2D6CYP3A4NPC1RAB9A | |
| SCHEMBL14119902 | 0.68 | CYP2C9 (0.33) | CYP2C9CYP2D6PLAU | |
| SCHEMBL14232278 | 0.68 | CYP2C9 (0.33) | CYP2C9CYP2D6PLAU | |
| SCHEMBL28356992 | 0.68 | BTK (0.35) | CYP2C9CYP2D6MEN1KMT2A | |
| SCHEMBL29749760 | 0.68 | PLAU (0.54) | CYP2C9CYP2D6CYP3A4NPC1RAB9A |
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-114133394-A | Compound selectively aiming at activity of cell cycle dependent kinase 12, preparation method and medical application | 赛诺哈勃药业（成都）有限公司 | 2022-03-04 | — | — | CN | disclosed |