Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 1/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.45 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CTSS | P25774 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL4867233 | 0.83 | POLB (0.44) | MAOBCYP1A2TSHRMEN1KMT2A | |
| SCHEMBL9022417 | 0.81 | ESR1 (0.49) | TAAR1SLC6A2CYP1A2CYP3A4MEN1 | |
| SCHEMBL9918239 | 0.81 | MAOB (0.47) | MAOBTAAR1SIGMAR1SLC6A2SLC6A4 | |
| SCHEMBL9725521 | 0.81 | TAAR1 (0.45) | TAAR1SIGMAR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL13685186 | 0.80 | MAOB (0.53) | MAOBTAAR1SIGMAR1SLC6A2SLC6A4 | |
| SCHEMBL4785594 | 0.76 | SIGMAR1 (0.64) | TAAR1SIGMAR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL24930325 | 0.75 | SIGMAR1 (0.52) | TAAR1SIGMAR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3082123 | 0.75 | SIGMAR1 (0.52) | TAAR1SIGMAR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL597195 | 0.75 | SIGMAR1 (0.52) | TAAR1SIGMAR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL14445691 | 0.75 | TRPA1 (0.42) | MAOBTAAR1SIGMAR1SLC6A2SLC6A4 |
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-6310033-B1 | 2,4-DIMETHYL-5-PHENYLPENTANAL; PERFUMES | BUSH BOAKE ALLEN INC. | 2001-10-30 | — | — | US | disclosed |