Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 2/20 | 0.55 |
| ▸ | MAOA | P21397 | 5/20 | 0.49 |
| ▸ | MAOB | P27338 | 5/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | HSPB1 | P04792 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.43 |
| ▸ | PGR | P06401 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL31718435 | 0.85 | KIF11 (0.50) | KIF11MAOAMAOBPKMSIRT2 | |
| SCHEMBL516986 | 0.84 | KIF11 (0.67) | KIF11PKMSIRT2CYP1A2CYP3A4 | |
| SCHEMBL29946501 | 0.84 | KIF11 (0.49) | KIF11MAOAMAOBPKMALDH1A1 | |
| SCHEMBL28965012 | 0.83 | ALDH1A1 (0.52) | KIF11MAOAMAOBPKMSIRT2 | |
| SCHEMBL4897946 | 0.82 | PGR (0.63) | KIF11SIRT2ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL31718431 | 0.80 | KIF11 (0.54) | KIF11PKMSIRT2CYP3A4MAPT | |
| SCHEMBL29946459 | 0.77 | PKM (0.45) | KIF11MAOAMAOBPKMALDH1A1 | |
| SCHEMBL29946515 | 0.77 | IDO1 (0.43) | KIF11MAOAMAOBPKMCYP1A2 | |
| SCHEMBL29946452 | 0.77 | KIF11 (0.42) | KIF11MAOAMAOBPKMMAPT | |
| SCHEMBL23787100 | 0.76 | PKM (0.66) | KIF11PKMALDH1A1KMT2AKDM4E |
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-115572260-A | Aryl ether compound and use thereof | 四川科伦博泰生物医药股份有限公司 | 2023-01-06 | — | — | CN | disclosed |