Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.35 |
| ▸ | USP2 | O75604 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30108302 | 0.78 | POLB (0.38) | CYP2C9USP2CYP1A2CYP2D6ALDH1A1 | |
| SCHEMBL30108294 | 0.77 | CYP2D6 (0.38) | CYP2C9USP2CYP1A2CYP2D6ALDH1A1 | |
| SCHEMBL2081988 | 0.70 | KMT2A (0.54) | CYP2C9USP2CYP1A2CYP2D6ALDH1A1 | |
| SCHEMBL22163904 | 0.68 | PDK1 (0.40) | USP2ALDH1A1CHRNB2CHRNA4CHRNB4 | |
| SCHEMBL22163907 | 0.68 | PDK1 (0.40) | USP2ALDH1A1CHRNB2CHRNA4CHRNB4 | |
| SCHEMBL5006363 | 0.65 | CHRNB2 (0.42) | CYP2C9CYP2D6CHRNB2CHRNA4CHRNB4 | |
| SCHEMBL5746952 | 0.65 | CYP2C9 (0.40) | CYP2C9USP2CYP1A2CYP2D6ALDH1A1 | |
| SCHEMBL3055828 | 0.65 | CYP3A4 (0.40) | CYP2C9USP2CYP1A2CYP2D6ALDH1A1 | |
| SCHEMBL3616921 | 0.65 | EPHX1 (0.38) | CYP2C9USP2CYP1A2CYP2D6ALDH1A1 | |
| SCHEMBL17608815 | 0.64 | USP2 (0.35) | CYP2C9USP2CYP1A2CYP2D6ALDH1A1 |
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-113549068-B | Novel imidazopyridine compound, preparation method and medical application thereof | 上海拓界生物医药科技有限公司 | 2022-12-02 | — | — | CN | disclosed |