Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 8/20 | 0.48 |
| ▸ | MAOA | P21397 | 6/20 | 0.48 |
| ▸ | ACHE | P22303 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 6/20 | 0.36 |
| ▸ | RCOR1 | Q9UKL0 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28590339 | 0.80 | MAOB (0.39) | MAOBMAOAACHETDP1KDM1A | |
| SCHEMBL20707753 | 0.78 | MAOB (0.45) | MAOBMAOAACHETDP1KDM1A | |
| SCHEMBL29989472 | 0.76 | KDM1A (0.48) | MAOBTDP1KDM1ARCOR1MAPT | |
| SCHEMBL30695906 | 0.76 | DDB1 (0.40) | MAOBMAOATDP1KDM1ARCOR1 | |
| SCHEMBL17028570 | 0.76 | KDM1A (0.48) | MAOBTDP1KDM1ARCOR1MAPT | |
| SCHEMBL23554855 | 0.76 | KDM1A (0.35) | MAOBMAOAKDM1ARCOR1 | |
| SCHEMBL3326226 | 0.76 | LMNA (0.46) | MAOBMAOAACHETDP1KDM1A | |
| SCHEMBL25556416 | 0.76 | KDM1A (0.32) | MAOBMAOAKDM1ARCOR1 | |
| SCHEMBL26933060 | 0.76 | ESR2 (0.41) | KDM1AMAPTALDH1A1LMNA | |
| SCHEMBL21610831 | 0.76 | HPGD (0.44) | ACHETDP1KDM1ARCOR1MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115057758-A | Fluorine-containing 1, 4-diene compound and derivative, site selective synthesis method and application | 四川大学 | 2022-09-16 | — | — | CN | disclosed |
| CN-113773168-A | Fluorine-containing 1, 4-diene compound, derivative and site selective synthesis method | 四川大学 | 2021-12-10 | — | — | CN | disclosed |
| EP-3433234-B1 | ALLOSTERIC MODULATORS OF NICOTINIC ACETYLCHOLINE RECEPTORS | MERCK SHARP & DOHME (US) | 2021-10-27 | — | — | EP | disclosed |