Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | ANPEP | P15144 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | BCHE | P06276 | 3/20 | 0.42 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 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 | |
|---|---|---|---|---|
| SCHEMBL1416237 | 0.81 | BCHE (0.48) | ALDH1A1CYP1A2CYP2D6ANPEPKMT2A | |
| SCHEMBL12539875 | 0.81 | BCHE (0.48) | ALDH1A1CYP1A2CYP2D6ANPEPKMT2A | |
| SCHEMBL4234996 | 0.81 | BCHE (0.48) | ALDH1A1CYP1A2CYP2D6ANPEPKMT2A | |
| SCHEMBL12540296 | 0.81 | BCHE (0.48) | ALDH1A1CYP1A2CYP2D6ANPEPKMT2A | |
| SCHEMBL12540335 | 0.81 | BCHE (0.48) | ALDH1A1CYP1A2CYP2D6ANPEPKMT2A | |
| SCHEMBL6990134 | 0.80 | ALDH1A1 (0.53) | TRPA1ALDH1A1CYP1A2CYP2D6ANPEP | |
| SCHEMBL6993511 | 0.80 | ALDH1A1 (0.53) | TRPA1ALDH1A1CYP1A2CYP2D6ANPEP | |
| SCHEMBL6990126 | 0.80 | ALDH1A1 (0.53) | TRPA1ALDH1A1CYP1A2CYP2D6ANPEP | |
| SCHEMBL4054297 | 0.79 | BCHE (0.47) | ALDH1A1CYP1A2CYP2D6ANPEPKMT2A | |
| SCHEMBL16264576 | 0.79 | MEN1 (0.56) | ALDH1A1CYP1A2CYP2D6ANPEPKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-8383636-B2 | Acyclic amine inhibitors of 5-methytioadenosine phosphorylase and nucleosidase | INDUSTRIAL RESEARCH LIMITED (NZ) | 2013-02-26 | — | — | US | disclosed |