Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 2/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.40 |
| ▸ | HTR1B | P28222 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | RXRA | P19793 | 1/20 | 0.35 |
| ▸ | RXRB | P28702 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3235894 | 0.75 | MAPT (0.38) | MAPTCYP1A2CYP2C19 | |
| SCHEMBL15800261 | 0.74 | HTR1D (0.44) | HTR1DADRA2AADRA2BADRA2CADRA1D | |
| SCHEMBL26802829 | 0.72 | HTR1D (0.45) | HTR1DADRA2AADRA2BADRA2CADRA1D | |
| SCHEMBL8849687 | 0.71 | HTR1D (0.42) | HTR1DADRA2AADRA2BADRA2CADRA1D | |
| SCHEMBL23402375 | 0.71 | HTR1D (0.44) | HTR1DADRA2AADRA2BADRA2CADRA1D | |
| SCHEMBL7979494 | 0.70 | KLF10 (0.47) | HTR1DADRA2AADRA2BADRA2CADRA1D | |
| SCHEMBL16153734 | 0.69 | TAAR1 (0.44) | CYP1A2CYP2C19ALDH1A1DAOPKM | |
| SCHEMBL24123873 | 0.68 | HTR1D (0.56) | HTR1DADRA2AADRA2BADRA2CADRA1D | |
| SCHEMBL23400064 | 0.68 | HTR1D (0.42) | HTR1DADRA2AADRA2BADRA2CADRA1D | |
| SCHEMBL1300900 | 0.67 | HTR1D (0.41) | HTR1DADRA2AADRA2BADRA2CADRA1D |
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-0652861-B1 | NOVEL AROMATIC COMPOUNDS AND THEIR USE IN PERFUME PRODUCTS | FIRMENICH & CIE (CH) | 1997-09-03 | — | — | EP | disclosed |
| US-5527769-A | AROMATIC ALDEHYDES OR ACETALS IMPART FLORAL FRAGRANCES | FIRMENICH SA (CH) | 1996-06-18 | — | — | US | disclosed |