Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPM8 | Q7Z2W7 | 13/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL30101766 | 1.00 | TRPM8 (0.43) | TRPM8HDAC3HDAC1HDAC8NCOR2 | |
| SCHEMBL28623643 | 0.86 | HDAC3 (0.40) | TRPM8HDAC3HDAC1HDAC8NCOR2 | |
| SCHEMBL30101825 | 0.86 | HDAC3 (0.40) | TRPM8HDAC3HDAC1HDAC8NCOR2 | |
| SCHEMBL30101826 | 0.86 | ESR1 (0.44) | TRPM8KDM4E | |
| SCHEMBL28625714 | 0.86 | ESR1 (0.44) | TRPM8KDM4E | |
| SCHEMBL30101863 | 0.86 | ESR1 (0.43) | — | |
| SCHEMBL6671821 | 0.86 | ESR1 (0.43) | — | |
| SCHEMBL28632884 | 0.85 | TRPM8 (0.39) | TRPM8HDAC3HDAC1HDAC8NCOR2 | |
| SCHEMBL28622036 | 0.83 | MEN1 (0.42) | MEN1KMT2A | |
| SCHEMBL28621530 | 0.83 | OPRM1 (0.41) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113264881-B | Synthetic method of alpha-cyanide | 南昌大学 | 2022-12-02 | — | — | CN | disclosed |
| CN-113264881-A | Synthetic method of alpha-cyanide | 南昌大学 | 2021-08-17 | — | — | CN | disclosed |