Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.62 |
| ▸ | MEN1 | O00255 | 4/20 | 0.62 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.62 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | NPC1 | O15118 | 3/20 | 0.55 |
| ▸ | RAB9A | P51151 | 3/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.52 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.52 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.52 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | ATM | Q13315 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL28583977 | 1.00 | KMT2A (0.62) | KMT2AMEN1RXFP1L3MBTL1ALDH1A1 | |
| SCHEMBL29768415 | 1.00 | KMT2A (0.62) | KMT2AMEN1RXFP1L3MBTL1ALDH1A1 | |
| SCHEMBL29768421 | 1.00 | KMT2A (0.62) | KMT2AMEN1RXFP1L3MBTL1ALDH1A1 | |
| SCHEMBL29768501 | 1.00 | KMT2A (0.62) | KMT2AMEN1RXFP1L3MBTL1ALDH1A1 | |
| SCHEMBL28584658 | 1.00 | KMT2A (0.62) | KMT2AMEN1RXFP1L3MBTL1ALDH1A1 | |
| SCHEMBL28582436 | 0.92 | KMT2A (0.59) | KMT2AMEN1RXFP1L3MBTL1ALDH1A1 | |
| SCHEMBL28582438 | 0.92 | KMT2A (0.59) | KMT2AMEN1RXFP1L3MBTL1ALDH1A1 | |
| SCHEMBL29768432 | 0.92 | KMT2A (0.59) | KMT2AMEN1RXFP1L3MBTL1ALDH1A1 | |
| SCHEMBL28915828 | 0.91 | MEN1 (0.76) | KMT2AMEN1RXFP1ALDH1A1NPC1 | |
| SCHEMBL28914925 | 0.91 | MEN1 (0.71) | KMT2AMEN1RXFP1ALDH1A1NPC1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112778154-B | Aryl alkyl ether compound and derivative thereof, preparation method, pharmaceutical composition and application | 中国药科大学 | 2022-05-13 | — | — | CN | claimed |
| CN-112778154-A | Aryl alkyl ether compound and derivative thereof, preparation method, pharmaceutical composition and application | 中国药科大学 | 2021-05-11 | — | — | CN | claimed |
| CN-112778154-B | Aryl alkyl ether compound and derivative thereof, preparation method, pharmaceutical composition and application | 中国药科大学 | 2022-05-13 | — | — | CN | disclosed |
| CN-112778154-A | Aryl alkyl ether compound and derivative thereof, preparation method, pharmaceutical composition and application | 中国药科大学 | 2021-05-11 | — | — | CN | disclosed |