Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC2 | Q92769 | 3/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.43 |
| ▸ | CTSK | P43235 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.37 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.37 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.37 |
| ▸ | CCR2 | P41597 | 1/20 | 0.34 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.31 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3629657 | 0.85 | HDAC2 (0.44) | HDAC2HDAC4HDAC8HDAC6CTSK | |
| SCHEMBL323973 | 0.81 | HDAC2 (0.47) | HDAC2HDAC4HDAC8HDAC6CTSK | |
| SCHEMBL11032178 | 0.80 | HDAC2 (0.43) | HDAC2HDAC4HDAC8HDAC6CTSK | |
| SCHEMBL2702713 | 0.79 | HDAC4 (0.40) | HDAC2HDAC4HDAC8HDAC6CTSK | |
| SCHEMBL28244702 | 0.75 | HDAC4 (0.46) | HDAC2HDAC4HDAC8HDAC6CTSK | |
| SCHEMBL6675022 | 0.74 | HDAC2 (0.52) | HDAC2HDAC4HDAC8HDAC6CTSK | |
| SCHEMBL3628786 | 0.74 | HDAC4 (0.41) | HDAC2HDAC4HDAC8HDAC6CTSK | |
| SCHEMBL2787548 | 0.73 | HDAC2 (0.50) | HDAC2HDAC4HDAC8HDAC6CTSK | |
| SCHEMBL2787554 | 0.73 | HDAC2 (0.50) | HDAC2HDAC4HDAC8HDAC6CTSK | |
| SCHEMBL7353788 | 0.73 | HDAC2 (0.50) | HDAC2HDAC4HDAC8HDAC6CTSK |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4480647-A | Use of cyclohexenyl-alkyl acrolein derivatives in augmenting or enhancing the aroma or taste of smoking tobacco compositions and smoking tobacco articles | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1984-11-06 | — | — | US | disclosed |