Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 1/20 | 0.34 |
| ▸ | ACACA | Q13085 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 8/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.32 |
| ▸ | USP2 | O75604 | 3/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.30 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.30 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL24388968 | 0.81 | SCN9A (0.32) | SCN9A | |
| SCHEMBL29637622 | 0.80 | ABHD6 (0.36) | ACACBACACACYP3A4USP2CYP2C19 | |
| SCHEMBL29637631 | 0.77 | PDE10A (0.33) | ACACBACACAUSP2HRH3ITGB3 | |
| SCHEMBL29930648 | 0.73 | SPR (0.42) | CYP3A4CYP1A2HSD17B10USP2CYP2C19 | |
| SCHEMBL29550671 | 0.71 | HRH3 (0.50) | CYP3A4CYP1A2HSD17B10USP2CYP2C19 | |
| SCHEMBL8316507 | 0.71 | HRH3 (0.50) | CYP3A4CYP1A2HSD17B10USP2CYP2C19 | |
| SCHEMBL24388975 | 0.70 | GPR119 (0.41) | ACACBACACA | |
| SCHEMBL24388798 | 0.70 | ACACB (0.37) | ACACBACACASCN9ATSHR | |
| SCHEMBL22499434 | 0.67 | SPR (0.43) | CYP2C19TSHRMAPK1KMT2AHRH3 | |
| SCHEMBL30738685 | 0.67 | MAPK1 (0.44) | CYP3A4CYP1A2USP2CYP2C19TSHR |
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-114478585-A | Nitrogen-containing fused heterocyclic compound and preparation method and application thereof | 上海青煜医药科技有限公司 | 2022-05-13 | — | — | CN | disclosed |