Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 3/20 | 0.57 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.47 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.45 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.44 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.44 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.44 |
| ▸ | AXL | P30530 | 2/20 | 0.44 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.44 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.44 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.43 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.43 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9007781 | 0.83 | CYP2A6 (0.62) | CYP2A6HSP90AA1HSP90AB1PTK2ALDH1A1 | |
| SCHEMBL2732457 | 0.83 | CYP2A6 (0.62) | CYP2A6HSP90AA1HSP90AB1PTK2ALDH1A1 | |
| SCHEMBL30419470 | 0.83 | CYP2A6 (0.47) | CYP2A6HSP90AA1HSP90AB1PTK2ALDH1A1 | |
| SCHEMBL19384206 | 0.82 | NOTUM (0.46) | NOTUMTGFBR1GABRA1GABRG2GABRB3 | |
| SCHEMBL3194702 | 0.81 | CYP2A6 (0.74) | CYP2A6HSP90AA1HSP90AB1PTK2ALDH1A1 | |
| SCHEMBL12278984 | 0.80 | HPGDS (0.50) | CYP2A6ALDH1A1CYP3A4CYP19A1TGFBR1 | |
| SCHEMBL3381636 | 0.80 | MEN1 (0.60) | NOTUMMEN1GABRA1GABRG2GABRB3 | |
| SCHEMBL12278291 | 0.78 | MEN1 (0.47) | CYP2A6ALDH1A1CYP1A2CYP3A4CYP19A1 | |
| SCHEMBL2183687 | 0.77 | IDH1 (0.41) | CYP2A6PTGS2TGFBR1MKNK1MEN1 | |
| SCHEMBL19384193 | 0.77 | CYP11B2 (0.42) | NOTUMTGFBR1GABRA1GABRG2GABRB3 |
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-116867758-A | IRAK degradation agents and uses thereof | 凯麦拉医疗公司 | 2023-10-10 | — | — | CN | disclosed |