Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.67 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.64 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.64 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.64 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL29353865 | 1.00 | NPSR1 (0.67) | NPSR1TAAR1SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL112940 | 1.00 | NPSR1 (0.67) | NPSR1TAAR1SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL29619783 | 1.00 | NPSR1 (0.67) | NPSR1TAAR1SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL13074977 | 1.00 | NPSR1 (0.67) | NPSR1TAAR1SLC6A4SLC6A2SLC6A3 | |
| Cyclohexene SCHEMBL21192507 | 0.92 | NPSR1 (0.58) | NPSR1TAAR1SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL8213676 | 0.88 | NPSR1 (0.54) | NPSR1TAAR1SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL28460858 | 0.84 | NPSR1 (0.56) | NPSR1TAAR1SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL6341532 | 0.84 | NPSR1 (0.50) | NPSR1TAAR1SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL2168560 | 0.83 | NPSR1 (0.61) | NPSR1TAAR1SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL2168564 | 0.83 | NPSR1 (0.61) | NPSR1TAAR1SLC6A4SLC6A2SLC6A3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3416612-A1 | FRAGRANT MIXTURES CONTAINING ESTERS AND KETONES | Symrise AG (DE) | 2018-12-26 | — | — | EP | disclosed |
| EP-2258696-A1 | Process for preparing enriched enantiomers of 3-(Benzo[1,3]dioxol-5-yl)-2-methylpropanal | ENDURA S.p.A. (IT) | 2010-12-08 | — | — | EP | disclosed |
| WO-2010131274-A1 | PROCESS FOR PREPARING HYDROCINNAMIC ALDEHYDES IN ENANTIOPURE OR ENANTIOMERICALLY ENRICHED FORM | ENDURA S.P.A (IT) | 2010-11-18 | — | — | WO | disclosed |