Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.62 |
| ▸ | F7 | P08709 | 1/20 | 0.51 |
| ▸ | F3 | P13726 | 1/20 | 0.51 |
| ▸ | SARM1 | Q6SZW1 | 1/20 | 0.51 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.51 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.51 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.51 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.51 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.51 |
| ▸ | SIRT4 | Q9Y6E7 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | CFTR | P13569 | 1/20 | 0.44 |
| ▸ | PLOD2 | O00469 | 1/20 | 0.43 |
| ▸ | PLOD3 | O60568 | 1/20 | 0.43 |
| ▸ | PLOD1 | Q02809 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Methyl Nicotinate SCHEMBL28879229 | 0.85 | ALDH1A1 (0.59) | ALDH1A1F7F3SARM1SIRT2 | |
| Methyl Nicotinate SCHEMBL28657691 | 0.84 | ALDH1A1 (0.83) | ALDH1A1F7F3SARM1SIRT2 | |
| Methyl Nicotinate SCHEMBL28281981 | 0.79 | ALDH1A1 (0.86) | ALDH1A1F7F3SARM1SIRT2 | |
| Methyl Nicotinate SCHEMBL27256603 | 0.79 | ALDH1A1 (0.93) | ALDH1A1F7F3SARM1SIRT2 | |
| Methyl Nicotinate SCHEMBL28210706 | 0.79 | ALDH1A1 (0.93) | ALDH1A1F7F3SARM1SIRT2 | |
| Methyl Nicotinate SCHEMBL820747 | 0.79 | ALDH1A1 (1.00) | ALDH1A1F7F3SARM1SIRT2 | |
| Methyl Nicotinate SCHEMBL24566 | 0.79 | ALDH1A1 (1.00) | ALDH1A1F7F3SARM1SIRT2 | |
| Methyl Nicotinate SCHEMBL29386553 | 0.79 | ALDH1A1 (1.00) | ALDH1A1F7F3SARM1SIRT2 | |
| Methyl Benzoate SCHEMBL28765090 | 0.78 | ALDH1A1 (0.73) | ALDH1A1F7F3SARM1SIRT2 | |
| Methyl Nicotinate SCHEMBL28181205 | 0.78 | ALDH1A1 (0.89) | ALDH1A1F7F3SARM1SIRT2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019163921-A1 | SUBSTITUTED PYRIDINE COMPOUND AND SALT THEREOF | 石原産業株式会社 | 2019-08-29 | — | — | WO | disclosed |