Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.67 |
| ▸ | CA1 | P00915 | 1/20 | 0.67 |
| ▸ | CA2 | P00918 | 1/20 | 0.67 |
| ▸ | TYR | P14679 | 1/20 | 0.67 |
| ▸ | CA7 | P43166 | 1/20 | 0.67 |
| ▸ | CA9 | Q16790 | 1/20 | 0.67 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.59 |
| ▸ | GLA | P06280 | 1/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.59 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.57 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.57 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.57 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.57 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.57 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.57 |
| ▸ | TNKS | O95271 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| E-Methyl Cinnamate SCHEMBL27554805 | 0.98 | CA12 (0.69) | CA12CA1CA2TYRCA7 | |
| E-Methyl Cinnamate SCHEMBL112062 | 0.98 | CA12 (0.69) | CA12CA1CA2TYRCA7 | |
| E-Methyl Cinnamate SCHEMBL27554806 | 0.98 | CA12 (0.69) | CA12CA1CA2TYRCA7 | |
| E-Methyl Cinnamate SCHEMBL1862419 | 0.98 | CA12 (0.69) | CA12CA1CA2TYRCA7 | |
| E-Methyl Cinnamate SCHEMBL101530 | 0.98 | CA12 (0.69) | CA12CA1CA2TYRCA7 | |
| E-Methyl Cinnamate SCHEMBL901224 | 0.98 | CA12 (0.69) | CA12CA1CA2TYRCA7 | |
| E-Methyl Cinnamate SCHEMBL2425288 | 0.98 | CA12 (0.69) | CA12CA1CA2TYRCA7 | |
| E-Methyl Cinnamate SCHEMBL28577208 | 0.96 | CA12 (0.67) | CA12CA1CA2TYRCA7 | |
| E-Methyl Cinnamate SCHEMBL6327040 | 0.96 | CA12 (0.67) | CA12CA1CA2TYRCA7 | |
| E-Methyl Cinnamate SCHEMBL11725144 | 0.96 | CA12 (0.67) | CA12CA1CA2TYRCA7 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113149942-A | Rockmilanol phenolic hydroxyl derivative, preparation method and application thereof | 贵州省中国科学院天然产物化学重点实验室(贵州医科大学天然产物化学重点实验室) | 2021-07-23 | — | — | CN | disclosed |