Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | TLR4 | O00206 | 1/20 | 0.36 |
| ▸ | NOS1 | P29475 | 4/20 | 0.36 |
| ▸ | NOS2 | P35228 | 4/20 | 0.36 |
| ▸ | NOS3 | P29474 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.33 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20357429 | 0.93 | CYP1A2 (0.53) | CYP1A2CYP2D6CHRM2CHRM4CHRM5 | |
| SCHEMBL25198213 | 0.93 | CYP1A2 (0.53) | CYP1A2CYP2D6CHRM2CHRM4CHRM5 | |
| SCHEMBL20357371 | 0.91 | CYP2D6 (0.46) | CYP1A2CYP2D6TP53NOS1NOS2 | |
| SCHEMBL30996494 | 0.89 | CYP1A2 (0.50) | CYP1A2CYP2D6TP53TLR4NOS1 | |
| SCHEMBL14369470 | 0.87 | CYP1A2 (0.50) | CYP1A2CYP2D6NOS1NOS2NOS3 | |
| SCHEMBL22468196 | 0.87 | CYP1A2 (0.50) | CYP1A2CYP2D6NOS1NOS2NOS3 | |
| SCHEMBL22468183 | 0.87 | CYP1A2 (0.50) | CYP1A2CYP2D6NOS1NOS2NOS3 | |
| SCHEMBL2927985 | 0.84 | CYP1A2 (0.57) | CYP1A2CYP2D6TLR4CHRM2CHRM4 | |
| SCHEMBL2933689 | 0.83 | CYP1A2 (0.56) | CYP1A2TLR4CHRM2CHRM4CHRM5 | |
| SCHEMBL2927438 | 0.83 | CYP1A2 (0.56) | CYP1A2TLR4CHRM2CHRM4CHRM5 |
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-115399467-A | Prune flavor type extract essence, preparation method thereof and application of prune flavor type extract essence in baking stuffing | 可菲生物科技有限公司 | 2022-11-29 | — | — | CN | disclosed |