Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 17/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 17/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 17/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 15/20 | 0.41 |
| ▸ | CLK4 | Q9HAZ1 | 9/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 8/20 | 0.41 |
| ▸ | TSHR | P16473 | 14/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.40 |
| ▸ | USP2 | O75604 | 6/20 | 0.40 |
| ▸ | LMNA | P02545 | 7/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 9/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 5/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27217633 | 1.00 | CYP1A2 (0.41) | CYP1A2CYP3A4CYP2C19CYP2D6CLK4 | |
| SCHEMBL30813319 | 0.90 | CYP1A2 (0.42) | CYP1A2CYP3A4CYP2C19CYP2D6CLK4 | |
| SCHEMBL27217742 | 0.90 | CYP1A2 (0.42) | CYP1A2CYP3A4CYP2C19CYP2D6CLK4 | |
| SCHEMBL27217743 | 0.80 | SRC (0.41) | CYP1A2CYP3A4CYP2C19CYP2D6CLK4 | |
| SCHEMBL27217801 | 0.80 | CYP1A2 (0.37) | CYP1A2CYP3A4CYP2C19CYP2D6CLK4 | |
| SCHEMBL21178740 | 0.78 | CYP1A2 (0.47) | CYP1A2CYP3A4CYP2C19CYP2D6CLK4 | |
| SCHEMBL30813537 | 0.78 | SRC (0.48) | MAPTMEN1KMT2A | |
| SCHEMBL27217722 | 0.78 | SRC (0.48) | MAPTMEN1KMT2A | |
| SCHEMBL30813528 | 0.76 | BRAF (0.40) | CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL27217940 | 0.76 | BRAF (0.40) | CYP1A2CYP3A4CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024059200-A1 | NEK7 INHIBITORS | Halia Therapeutics, Inc. (US) | 2024-03-21 | — | — | WO | disclosed |