Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.68 |
| ▸ | KCNK3 | O14649 | 3/20 | 0.63 |
| ▸ | KCNK9 | Q9NPC2 | 3/20 | 0.63 |
| ▸ | HPGD | P15428 | 1/20 | 0.62 |
| ▸ | F2R | P25116 | 2/20 | 0.61 |
| ▸ | POLB | P06746 | 4/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.59 |
| ▸ | PKM | P14618 | 1/20 | 0.59 |
| ▸ | RAB9A | P51151 | 1/20 | 0.59 |
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.56 |
| ▸ | THRB | P10828 | 1/20 | 0.56 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.56 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.56 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.56 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.55 |
| ▸ | AURKA | O14965 | 1/20 | 0.54 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL11668137 | 0.85 | KCNK3 (0.84) | SMN1; SMN2ALDH1A1KCNK3KCNK9HPGD | |
| SCHEMBL27484183 | 0.84 | FADS1 (0.60) | SMN1; SMN2ALDH1A1HPGDAURKB | |
| SCHEMBL17538569 | 0.84 | ALDH1A1 (0.63) | ALDH1A1KMT2AMEN1AURKB | |
| SCHEMBL27952999 | 0.83 | AURKB (0.56) | SMN1; SMN2ALDH1A1AURKB | |
| SCHEMBL27795055 | 0.82 | PLG (0.60) | KMT2ARAB9AMEN1SIRT2SIRT3 | |
| SCHEMBL533767 | 0.80 | KCNK3 (0.81) | SMN1; SMN2ALDH1A1KCNK3KCNK9HPGD | |
| SCHEMBL6681834 | 0.79 | KCNK3 (0.69) | KCNK3KCNK9HPGDPOLBKMT2A | |
| SCHEMBL11305192 | 0.79 | KCNK3 (0.70) | SMN1; SMN2ALDH1A1KCNK3KCNK9HPGD | |
| SCHEMBL14818771 | 0.78 | KCNK3 (0.74) | SMN1; SMN2ALDH1A1KCNK3KCNK9HPGD | |
| SCHEMBL3003205 | 0.78 | CFD (0.59) | SMN1; SMN2AURKB |
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 |
|---|---|---|---|---|---|---|---|
| EP-3822253-A1 | METHOD FOR PREPARING PROPANEDINITRILE OXIME ETHER COMPOUND AND INTERMEDIATE COMPOUND | Shenyang Sinochem Agrochemicals R&D Co., Ltd. (CN) | 2021-05-19 | — | — | EP | disclosed |