Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | MAOB | P27338 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8620900 | 0.83 | ASIC3 (0.44) | ACACBMAPTASIC3KMT2AATM | |
| SCHEMBL29116861 | 0.82 | RARB (0.46) | ACACBMAPTASIC3KMT2AATM | |
| SCHEMBL29096084 | 0.82 | MAPT (0.43) | ACACBMAPTASIC3KMT2AATM | |
| SCHEMBL29096081 | 0.82 | HSD11B1 (0.37) | MAPTASIC3KMT2AATMNOS1 | |
| SCHEMBL29116864 | 0.81 | MAPT (0.53) | MAPTASIC3KMT2ALMNAKDM4E | |
| SCHEMBL11216394 | 0.78 | ASIC3 (0.41) | MAPTASIC3KMT2AATMLMNA | |
| SCHEMBL29116863 | 0.77 | ACACB (0.46) | ACACBMAPT | |
| Bicarbonate SCHEMBL28546564 | 0.76 | HAO1 (0.45) | ACACBMAPTASIC3KMT2ALMNA | |
| SCHEMBL22881118 | 0.74 | HRH3 (0.41) | ACACBMAPTKMT2AATMCYP2D6 | |
| SCHEMBL11551623 | 0.74 | HAO1 (0.49) | MAPTASIC3LMNAL3MBTL1KDM4E |
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-116969819-A | Method for realizing visible light-induced intramolecular alkynyl migration of 1, 4-eneyne compound and realizing unactivated olefin difunctional | 哈尔滨工业大学 | 2023-10-31 | — | — | CN | disclosed |