Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 3/20 | 0.78 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.78 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.37 |
| ▸ | SQLE | Q14534 | 2/20 | 0.33 |
| ▸ | GGPS1 | O95749 | 2/20 | 0.33 |
| ▸ | FDPS | P14324 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Citronellol SCHEMBL28159173 | 0.91 | ALOX15 (0.70) | ALOX15ALDH1A1USP2TDP1TSHR | |
| Citronellol SCHEMBL3372997 | 0.88 | ALOX15 (0.91) | ALOX15ALDH1A1USP2TDP1TSHR | |
| Citronellol SCHEMBL8758931 | 0.88 | ALOX15 (0.91) | ALOX15ALDH1A1USP2TDP1TSHR | |
| Citronellol SCHEMBL301394 | 0.88 | ALOX15 (1.00) | ALOX15ALDH1A1USP2TDP1TSHR | |
| Citronellol SCHEMBL21320 | 0.88 | ALOX15 (1.00) | ALOX15ALDH1A1USP2TDP1TSHR | |
| Citronellol SCHEMBL1871004 | 0.88 | ALOX15 (1.00) | ALOX15ALDH1A1USP2TDP1TSHR | |
| Citronellol SCHEMBL18301310 | 0.88 | ALOX15 (1.00) | ALOX15ALDH1A1USP2TDP1TSHR | |
| (+)-Citronellol SCHEMBL21321 | 0.88 | ALOX15 (1.00) | ALOX15ALDH1A1USP2TDP1TSHR | |
| Citronellol SCHEMBL27896071 | 0.86 | ALOX15 (0.88) | ALOX15ALDH1A1USP2TDP1TSHR | |
| Citronellol SCHEMBL17688817 | 0.86 | ALOX15 (0.95) | ALOX15ALDH1A1USP2TDP1TSHR |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104003904-B | 4,8-dimethyl-4,9-decadienenitrile | 花王株式会社 | 2017-04-19 | — | — | CN | disclosed |
| CN-104884431-B | Nitrile compound | KAO CORP. (JP) | 2016-11-30 | — | — | CN | disclosed |
| CN-103006509-A | Emulsion composition and wet tissue applying emulsion composition | GOLD HONG YE PAPER CO LTD | 2013-04-03 | — | — | CN | disclosed |
| US-5013476-A | Ferroelectric properties, electro-optical indicating device | HOFFMANN-LA ROCHE INC. (US) | 1991-05-07 | — | — | US | disclosed |