Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.60 |
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.50 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.48 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | FBP1 | P09467 | 3/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | TNKS | O95271 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10643212 | 0.86 | ALDH1A1 (0.52) | ALDH1A1TSHRCYP2A6AKR1C3AKR1C1 | |
| SCHEMBL7167811 | 0.84 | ALDH1A1 (0.55) | ALDH1A1TSHRLMNATDP1MAPK1 | |
| SCHEMBL155213 | 0.79 | ALDH1A1 (0.60) | ALDH1A1TSHRCYP2A6AKR1C3AKR1C1 | |
| SCHEMBL1759350 | 0.79 | ALDH1A1 (0.60) | ALDH1A1TSHRCYP2A6AKR1C3AKR1C1 | |
| SCHEMBL6331873 | 0.79 | ALDH1A1 (0.60) | ALDH1A1TSHRCYP2A6AKR1C3AKR1C1 | |
| SCHEMBL6331875 | 0.79 | ALDH1A1 (0.60) | ALDH1A1TSHRCYP2A6AKR1C3AKR1C1 | |
| SCHEMBL25263515 | 0.78 | ALDH1A1 (0.53) | ALDH1A1TSHRCYP2A6AKR1C3LMNA | |
| Hydrogen Sulfide SCHEMBL28269184 | 0.77 | ALDH1A1 (0.58) | ALDH1A1TSHRCYP2A6AKR1C3AKR1C1 | |
| SCHEMBL28532750 | 0.77 | ALDH1A1 (0.58) | ALDH1A1TSHRCYP2A6AKR1C3AKR1C1 | |
| SCHEMBL567062 | 0.75 | ALDH1A1 (0.56) | ALDH1A1TSHRCYP2A6AKR1C3AKR1C1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1994309-A | Use of caryophyllene compound composition in medicine for treating general anxiety neurosis and depression | ZHENG LEJIAN (CN) | 2007-07-11 | — | — | CN | claimed |
| CN-119307205-A | Formaldehyde-free adhesive for artificial board and preparation method thereof | 山东顺创新材料科技有限公司 | 2025-01-14 | — | — | CN | disclosed |
| CN-109666163-B | Hybrid crosslinked dynamic polymer and application thereof | 厦门逍扬运动科技有限公司 | 2023-05-12 | — | — | CN | disclosed |
| CN-109666162-A | A kind of energy-absorbing method based on dynamic crosslinking polymer | 翁秋梅 | 2019-04-23 | — | — | CN | disclosed |
| CN-104043066-A | Chinese herbal medicine extract for promoting hair growth, blackening hair and improving dandruff and application thereof | JI TINGHUANG | 2014-09-17 | — | — | CN | disclosed |