Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 5/20 | 0.40 |
| ▸ | CHRM5 | P08912 | 5/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 5/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 4/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL25838285 | 0.87 | CHRM2 (0.37) | CHRM2CHRM5CHRM3CHRM4CHRM1 | |
| SCHEMBL25257547 | 0.82 | MEN1 (0.35) | CHRM2CHRM5CHRM3CHRM4CHRM1 | |
| SCHEMBL25296356 | 0.82 | MEN1 (0.35) | CHRM2CHRM5CHRM3CHRM4CHRM1 | |
| SCHEMBL25838495 | 0.73 | KCNH2 (0.33) | CHRM2CHRM5CHRM3CHRM4CHRM1 | |
| SCHEMBL25302799 | 0.71 | L3MBTL1 (0.33) | CHRM2CHRM5CHRM3CHRM4CHRM1 | |
| SCHEMBL25302800 | 0.71 | L3MBTL1 (0.33) | CHRM2CHRM5CHRM3CHRM4CHRM1 | |
| SCHEMBL30068916 | 0.71 | MET (0.39) | — | |
| SCHEMBL25300265 | 0.71 | MET (0.39) | — | |
| SCHEMBL25300264 | 0.71 | MET (0.39) | — | |
| SCHEMBL25838497 | 0.70 | THRB (0.33) | HSD17B10 |
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-2023131122-A1 | FUSED RING-SUBSTITUTED SIX-MEMBERED HETEROCYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 劲方医药科技(上海)有限公司 | 2023-07-13 | — | — | WO | disclosed |