Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.65 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.65 |
| ▸ | PLOD2 | O00469 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | APP | P05067 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.53 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.53 |
| ▸ | PLOD3 | O60568 | 1/20 | 0.53 |
| ▸ | PLOD1 | Q02809 | 1/20 | 0.53 |
| ▸ | F7 | P08709 | 1/20 | 0.52 |
| ▸ | F3 | P13726 | 1/20 | 0.52 |
| ▸ | SARM1 | Q6SZW1 | 1/20 | 0.52 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.52 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.52 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.52 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.52 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.52 |
| ▸ | SIRT4 | Q9Y6E7 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL2945748 | 1.00 | HDAC1 (0.65) | HDAC1HDAC8PLOD2ALDH1A1APP | |
| SCHEMBL8545882 | 0.95 | HDAC1 (0.68) | HDAC1HDAC8PLOD2ALDH1A1APP | |
| SCHEMBL9549825 | 0.93 | HDAC1 (0.70) | HDAC1HDAC8PLOD2ALDH1A1APP | |
| SCHEMBL9405126 | 0.89 | PLOD2 (0.62) | HDAC1HDAC8PLOD2ALDH1A1APP | |
| SCHEMBL4947413 | 0.87 | PLOD2 (0.61) | HDAC1HDAC8PLOD2ALDH1A1APP | |
| SCHEMBL7075878 | 0.87 | PLOD2 (0.69) | HDAC1HDAC8PLOD2ALDH1A1APP | |
| SCHEMBL13518550 | 0.84 | HDAC1 (0.56) | HDAC1HDAC8PLOD2ALDH1A1APP | |
| SCHEMBL8572804 | 0.84 | HDAC1 (0.63) | HDAC1HDAC8PLOD2ALDH1A1APP | |
| SCHEMBL552456 | 0.84 | HDAC1 (0.63) | HDAC1HDAC8PLOD2ALDH1A1APP | |
| SCHEMBL17700981 | 0.84 | HDAC1 (0.63) | HDAC1HDAC8PLOD2ALDH1A1APP |
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 |
|---|---|---|---|---|---|---|---|
| CN-115404249-B | Preparation method and application of (S) -nicotine intermediate | 重庆博腾制药科技股份有限公司 | 2024-07-05 | — | — | CN | disclosed |
| CN-115404249-A | Preparation method and application of (S) -nicotine intermediate | 重庆博腾制药科技股份有限公司 | 2022-11-29 | — | — | CN | disclosed |