Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | WNT1 | P04628 | 3/20 | 0.36 |
| ▸ | GSK3B | P49841 | 3/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.36 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 7/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.35 |
| ▸ | USP2 | O75604 | 4/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.35 |
| ▸ | CLK2 | P49760 | 1/20 | 0.35 |
| ▸ | CLK3 | P49761 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.34 |
| ▸ | TBK1 | Q9UHD2 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MAPK7 | Q13164 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19905265 | 0.88 | SYK (0.39) | GSK3BDYRK1ACLK4CYP1A2CYP3A4 | |
| SCHEMBL19905408 | 0.86 | CLK4 (0.37) | DYRK1ACLK4CYP1A2CYP3A4USP2 | |
| SCHEMBL17634662 | 0.86 | PRKDC (0.47) | WNT1GSK3BDYRK1APIK3CDCLK4 | |
| SCHEMBL19905140 | 0.85 | CYP1A2 (0.37) | WNT1GSK3BDYRK1ACLK4CYP1A2 | |
| SCHEMBL19355474 | 0.85 | DYRK1A (0.39) | WNT1GSK3BDYRK1ACLK4CYP1A2 | |
| SCHEMBL19819884 | 0.84 | CYP1A2 (0.38) | CLK4CYP1A2CYP3A4USP2CYP2C19 | |
| SCHEMBL19905058 | 0.83 | CYP1A2 (0.38) | CLK4CYP1A2CYP3A4USP2CYP2C19 | |
| SCHEMBL19355439 | 0.82 | USP2 (0.37) | CLK4CYP1A2CYP3A4USP2CYP2C19 | |
| SCHEMBL19355532 | 0.82 | CYP1A2 (0.37) | CLK4CYP1A2CYP3A4USP2CYP2C19 | |
| SCHEMBL19905196 | 0.82 | CLK4 (0.39) | GSK3BCLK4CYP1A2CYP3A4USP2 |
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-3057959-B1 | DNA-PK INHIBITORS | VERTEX PHARMA (US) | 2018-02-28 | — | — | EP | disclosed |