Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 2/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | FDFT1 | P37268 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 3/20 | 0.36 |
| ▸ | HTR2A | P28223 | 2/20 | 0.36 |
| ▸ | HTR2B | P41595 | 2/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.36 |
| ▸ | DRD3 | P35462 | 2/20 | 0.36 |
| ▸ | CASR | P41180 | 2/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1653046 | 0.82 | HTR2A (0.49) | BCHEBACE1CYP2D6SIGMAR1TP53 | |
| SCHEMBL14750 | 0.81 | HTR2C (0.49) | BCHEBACE1FDFT1CYP2D6SIGMAR1 | |
| SCHEMBL115558 | 0.81 | KCNH2 (0.49) | SIGMAR1TP53TSHRKCNH2 | |
| SCHEMBL1653903 | 0.80 | CYP4F2 (0.46) | BCHEBACE1CYP2D6SIGMAR1TP53 | |
| SCHEMBL9592544 | 0.78 | CYP4F2 (0.49) | BCHEHDAC8HDAC4HDAC2ACHE | |
| SCHEMBL27810300 | 0.77 | HTR2A (0.42) | BCHEBACE1CYP2D6SIGMAR1TP53 | |
| SCHEMBL12061425 | 0.77 | HTR2C (0.44) | BCHEBACE1FDFT1CYP2D6SIGMAR1 | |
| SCHEMBL6991568 | 0.77 | MMP2 (0.35) | TP53CYP1A2CYP3A4TSHRCYP2C19 | |
| SCHEMBL475557 | 0.77 | TDP1 (0.46) | BCHEBACE1CYP1A2CYP2C19HDAC8 | |
| SCHEMBL111796 | 0.77 | TRPA1 (0.47) | CYP2D6SIGMAR1CYP2C19HDAC8HDAC4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0908439-B1 | Use of substituted 5-phenyl-pentanols as flavour and perfume | HAARMANN & REIMER GMBH (DE) | 2003-01-02 | — | — | EP | disclosed |
| EP-0908439-A1 | Use of substituted 5-phenyl-pentanols as flavour and perfume | HAARMANN & REIMER GMBH (DE) | 1999-04-14 | — | — | EP | disclosed |