Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 4/20 | 0.44 |
| ▸ | ESR1 | P03372 | 3/20 | 0.41 |
| ▸ | IDO1 | P14902 | 2/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.41 |
| ▸ | ACACB | O00763 | 2/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.38 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.38 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.38 |
| ▸ | ALB | P02768 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | RARB | P10826 | 1/20 | 0.38 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.38 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL20610522 | 0.90 | ESR1 (0.45) | TRPA1ESR1IDO1ESR2ACACB | |
| SCHEMBL1219827 | 0.90 | ESR1 (0.45) | TRPA1ESR1IDO1ESR2ACACB | |
| SCHEMBL9455527 | 0.82 | IDO1 (0.45) | ESR1IDO1ESR2ACACBPTGS1 | |
| SCHEMBL17171333 | 0.80 | TRPA1 (0.59) | TRPA1 | |
| SCHEMBL110694 | 0.80 | TRPA1 (0.59) | TRPA1 | |
| SCHEMBL6989159 | 0.78 | TP53 (0.50) | TRPA1ACACBLMNATSHREPHX1 | |
| SCHEMBL24648909 | 0.76 | IDO1 (0.48) | TRPA1ESR1IDO1ESR2ACACB | |
| SCHEMBL24648911 | 0.76 | IDO1 (0.48) | TRPA1ESR1IDO1ESR2ACACB | |
| SCHEMBL18570895 | 0.75 | IDO1 (0.47) | ESR1IDO1ESR2ACACBPTGS1 | |
| SCHEMBL8840397 | 0.74 | IDO1 (0.50) | ESR1IDO1ESR2ACACBEPHX1 |
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 |